6-hydroxy-1,3-dimethyl-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-hydroxy-1,3-dimethyl-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
6-hydroxy-1,3-dimethyl-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-1891 |
| Compound Name: | 6-hydroxy-1,3-dimethyl-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | CN1C(=C(C2CC(c3ccccc3)Sc3ccccc3N=2)C(N(C)C1=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1478 |
| logD: | -2.2336 |
| logSw: | -3.2946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.832 |
| InChI Key: | SCJSCTLIRYKGPL-KRWDZBQOSA-N |