3-(4-chlorophenyl)-6-hydroxy-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-6-hydroxy-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
3-(4-chlorophenyl)-6-hydroxy-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-2171 |
| Compound Name: | 3-(4-chlorophenyl)-6-hydroxy-5-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 475.95 |
| Molecular Formula: | C25 H18 Cl N3 O3 S |
| Smiles: | C1C(c2ccccc2)Sc2ccccc2N=C1C1=C(NC(N(C1=O)c1ccc(cc1)[Cl])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4152 |
| logD: | -2.1563 |
| logSw: | -4.7079 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.66 |
| InChI Key: | PTUINWDCJLRVGI-NRFANRHFSA-N |