3-(3-chlorophenyl)-6-hydroxy-5-[2-(pyridin-3-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-6-hydroxy-5-[2-(pyridin-3-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
3-(3-chlorophenyl)-6-hydroxy-5-[2-(pyridin-3-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-2342 |
| Compound Name: | 3-(3-chlorophenyl)-6-hydroxy-5-[2-(pyridin-3-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 476.94 |
| Molecular Formula: | C24 H17 Cl N4 O3 S |
| Smiles: | C1C(c2cccnc2)Sc2ccccc2N=C1C1=C(NC(N(C1=O)c1cccc(c1)[Cl])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2614 |
| logD: | -3.31 |
| logSw: | -3.624 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.177 |
| InChI Key: | AVFNOTYEDFMLBO-FQEVSTJZSA-N |