Chem 3 Methyl 2 246 Trimethoxyphenyloxazolidine Dsrpl

Compound 361
  CheckMol                        TMF02:r0:m0
MF=C13H19NO4 MW=253.30
 18 19  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2280   -0.8738   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4723    1.4405   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4560    0.0236   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2398   -2.3615   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.9837    1.4523   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8965   -0.4251   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0472   -3.0936   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.5504   -3.1054   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.3342   -2.3261   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0354   -4.5813   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.8610   -2.3497   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5622   -4.5931   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.3224   -0.8147   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2752   -5.3252   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.1717   -3.0817   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2870   -6.8129   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -7.5450   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  1  0  0
  1  3  1  0  1  0  0
  2  4  1  0  1  0  0
  2  5  1  0  0  0  0
  3  6  1  0  1  0  0
  4  7  1  0  0  0  0
  5  8 02  0  1  0  0
  5  9 01  0  1  0  0
  8 10  1  0  0  0  0
  8 11 01  0  1  0  0
  9 12  1  0  0  0  0
  9 13 02  0  1  0  0
 10 14  1  0  0  0  0
 11 15 02  0  1  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
  4  6  1  0  1  0  0
 13 15 01  0  1  0  0
M  END

3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine

₹ 0.00 0.00

Chemical Name - 3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine
Mol Weight - 253.297
Smiles - CN1C(c(c(OC)cc(OC)c2)c2OC)OCC1

Property Name	Property Value
Mol Name	3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine
Molweight	253.297
Monoisotopic Mass	253.131409
Clogp	0.9147
Clogs	-1.139
H Acceptors	5
Total Surface Area	199.12
Relative Psa	0.21871
Polar Surface Area	40.16
Druglikeness	4.2436
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.5
Molecular Flexibility	0.37391
Molecular Complexity	0.74806
Fragments	1
Non H Atoms	18
Non Ch Atoms	5
Electronegative Atoms	5
Stereo Centers	1
Rotatable Bonds	4
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	12
Symmetric Atoms	4
Basic Nitrogens	1
Smiles	CN1C(c(c(OC)cc(OC)c2)c2OC)OCC1
InChIKey	InChI=1S/C13H19NO4/c1-14-5-6-18-13(14)12-10(16-3)7-9(15-2)8-11(12)17-4/h7-8,13H,5-6H2,1-4H3
InChI	BHLAYNZWHMXGAZ-UHFFFAOYSA-N

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1 - 3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine
2 - 3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine

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3-Methyl-2-(2,4,6-trimethoxyphenyl)oxazolidine