N-(5-chloro-2-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(5-chloro-2-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
Compound ID: | K801-0410 |
Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
Molecular Weight: | 427.95 |
Molecular Formula: | C22 H22 Cl N3 O2 S |
Smiles: | COc1ccc(cc1NC(c1c2CCCCc2sc1NCc1ccccn1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.8036 |
logD: | 4.7936 |
logSw: | -5.0122 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.755 |
InChI Key: | GZWISOJWQWUFSH-UHFFFAOYSA-N |