2,5-dimethyl-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Chemical Structure Depiction of
2,5-dimethyl-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
2,5-dimethyl-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Compound characteristics
Compound ID: | P895-0008 |
Compound Name: | 2,5-dimethyl-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide |
Molecular Weight: | 389.47 |
Molecular Formula: | C22 H19 N3 O2 S |
Smiles: | Cc1ccc(C)c(c1)C(Nc1ccc2c(c1)Sc1c(cccn1)C(N2C)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9792 |
logD: | 3.979 |
logSw: | -4.0987 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.582 |
InChI Key: | OMUHOMZOKYTRLP-UHFFFAOYSA-N |