propan-2-yl 2-[(4-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula:C20H23NO4S Mutagenic:none Tumorigenic:none Reproductive Effective:none propan-2-yl 2-[(4-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is a drug-like molecule.

MolName	propan-2-yl 2-[(4-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MolecularFormula	C20H23NO4S
Smiles	CC(C)OC(c1c(NC(c(cc2)ccc2OC)=O)sc2c1CCCC2)=O
InChI	InChI=1S/C20H23NO4S/c1-12(2)25-20(23)17-15-6-4-5-7-16(15)26-19(17)21-18(22)13-8-10-14(24-3)11-9-13/h8-12H,4-7H2,1-3H3,(H,21,22)
InChIK	SLTLOMWOTUGFPJ-UHFFFAOYSA-N
TotalMolweight	373.472
Molweight	373.472
MonoisotopicMass	373.134779
CLogP	4.6287
CLogS	-5.217
H Acceptors	5
H Donors	1
TotalSurfaceArea	286.74
Relative PSA	0.27167
PolarSurfaceArea	92.87
Druglikeness	-4.1729
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	10
Symmetricatoms	3
Amides	1
StereoCon

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1 - propan-2-yl 2-[(4-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | 2 - propan-2-yl 2-[(4-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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