(E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine

Formula:C18H14N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:low (E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine is a drug-like molecule.

MolName	(E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine
MolecularFormula	C18H14N4O2Cl2
Smiles	Clc1ccc(CO/N=C2\c(ccc(Cl)c3)c3OCC2n2ncnc2)cc1
InChI	InChI=1S/C18H14Cl2N4O2/c19-13-3-1-12(2-4-13)8-26-23-18-15-6-5-14(20)7-17(15)25-9-16(18)24-11-21-10-22-24/h1-7,10-11,16H,8-9H2/t16-/m1/s1
InChIK	NULMJACOWIROPI-MRXNPFEDSA-N
TotalMolweight	389.241
Molweight	389.241
MonoisotopicMass	388.04938
CLogP	4.5214
CLogS	-5.034
H Acceptors	6
TotalSurfaceArea	279.83
Relative PSA	0.21556
PolarSurfaceArea	61.53
Druglikeness	4.0501
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon	racemate

Click to Load Molecule:

1 - (E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine | 2 - (E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine

Request More Details | (E)-7-chloro-N-[(4-chlorophenyl)methoxy]-3-(1,2,4-triazol-1-yl)-2,3-dihydrochromen-4-imine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments