9-[4-(propan-2-yl)piperazine-1-carbonyl]-6-propylpyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Chemical Structure Depiction of
9-[4-(propan-2-yl)piperazine-1-carbonyl]-6-propylpyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
9-[4-(propan-2-yl)piperazine-1-carbonyl]-6-propylpyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Compound characteristics
| Compound ID: | P617-0536 |
| Compound Name: | 9-[4-(propan-2-yl)piperazine-1-carbonyl]-6-propylpyrido[2,3-b][1,5]benzothiazepin-5(6H)-one |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CCCN1C(c2cccnc2Sc2cc(ccc12)C(N1CCN(CC1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1285 |
| logD: | 2.7955 |
| logSw: | -3.4174 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.215 |
| InChI Key: | CXYHRXHQJOKXMY-UHFFFAOYSA-N |