propyl 4-{2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
propyl 4-{2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
propyl 4-{2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | D365-0187 |
| Compound Name: | propyl 4-{2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C19 H21 N3 O4 S |
| Smiles: | CCCOC(c1ccc(cc1)NC(CSC1NC(C2CCCC=2N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7606 |
| logD: | 2.5454 |
| logSw: | -3.1949 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.035 |
| InChI Key: | NEQBLVQYZZGKQI-UHFFFAOYSA-N |