6-hydroxy-3-methyl-5-[2-(naphthalen-1-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-hydroxy-3-methyl-5-[2-(naphthalen-1-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
6-hydroxy-3-methyl-5-[2-(naphthalen-1-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-2468 |
| Compound Name: | 6-hydroxy-3-methyl-5-[2-(naphthalen-1-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C24 H19 N3 O3 S |
| Smiles: | CN1C(C(=C(NC1=O)O)C1CC(c2cccc3ccccc23)Sc2ccccc2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.905 |
| logD: | -2.2995 |
| logSw: | -3.9069 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.037 |
| InChI Key: | OOXCGAJQFNYEIT-FQEVSTJZSA-N |