Chem 1 26 Dichlorophenyl 2 Indolinone Bcipl

Compound 72
  CheckMol                        TMF02:r0:m0
MF=C14H9Cl2NO MW=278.14
 18 20  0  4  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5089   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3203    2.2751   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2731    2.2633   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6287    1.5324   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3320    3.7840   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2613    3.7722   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.7938    0.0589   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.0079    2.1572   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6405    4.5502   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0472    4.5384   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.2673   -0.2358   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.8036   -1.0373   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.3262    3.6307   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0217    1.0609   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7388   -1.6503   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.2751   -2.4519   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.7486   -2.7466   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5  1  0  0  0  0
  3  6 01  0  1  0  0
  4  7 02  0  1  0  0
  5  8  1  0  1  0  0
  5  9  1  0  1  0  0
  6 10  1  0  0  0  0
  6 11 02  0  1  0  0
  8 12 02  0  2  0  0
  8 13 01  0  1  0  0
  9 14  2  0  0  0  0
  9 15  1  0  1  0  0
 12 16 01  0  1  0  0
 13 17 02  0  1  0  0
 16 18 02  0  1  0  0
  7 11 01  0  1  0  0
 12 15  1  0  1  0  0
 17 18 01  0  1  0  0
M  END

1-(2,6-Dichlorophenyl)-2-Indolinone

₹ 0.00 0.00

Chemical Name - 1-(2,6-Dichlorophenyl)-2-Indolinone
Mol Weight - 278.137
Smiles - O=C(Cc1c2cccc1)N2c(c(Cl)ccc1)c1Cl
InChI - JCICIFOYVSPMHG-UHFFFAOYSA-N
InChIKey - InChI=1S/C14H9Cl2NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(17)18/h1-7H,8H2

Property Name	Property Value
Mol Name	1-(2,6-Dichlorophenyl)-2-Indolinone
Molweight	278.137
Monoisotopic Mass	277.006118
Clogp	4.1557
Clogs	-5.475
H Acceptors	2
Total Surface Area	192.17
Relative Psa	0.08633
Polar Surface Area	20.31
Druglikeness	1.5053
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Shape Index	0.5
Molecular Flexibility	0.25065
Molecular Complexity	0.84284
Fragments	1
Non H Atoms	18
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	1
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	1
Symmetric Atoms	3
Amides	1
Smiles	O=C(Cc1c2cccc1)N2c(c(Cl)ccc1)c1Cl
InChIKey	InChI=1S/C14H9Cl2NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(17)18/h1-7H,8H2
InChI	JCICIFOYVSPMHG-UHFFFAOYSA-N

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1 - 1-(2,6-Dichlorophenyl)-2-Indolinone
2 - 1-(2,6-Dichlorophenyl)-2-Indolinone

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1-(2,6-Dichlorophenyl)-2-Indolinone