ethyl 2-{2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamido}benzoate
ethyl 2-{2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | L938-0036 |
| Compound Name: | ethyl 2-{2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C23 H20 N4 O3 S |
| Smiles: | CCOC(c1ccccc1NC(CSc1c2c(c(c[nH]2)c2ccccc2)ncn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3552 |
| logD: | 4.3376 |
| logSw: | -4.2069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.24 |
| InChI Key: | DVUPVWMSWYTUCO-UHFFFAOYSA-N |