N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-4-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-4-(propan-2-yl)benzamide
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-4-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | P895-0052 |
| Compound Name: | N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-4-(propan-2-yl)benzamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C(Nc1ccc2c(c1)Sc1c(cccn1)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4593 |
| logD: | 4.4593 |
| logSw: | -4.3016 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.582 |
| InChI Key: | OVSXUPBSOPJNDP-UHFFFAOYSA-N |