4-{[(4-tert-butylphenyl)methyl]sulfanyl}-7-phenyl-5H-pyrrolo[3,2-d]pyrimidine
Chemical Structure Depiction of
4-{[(4-tert-butylphenyl)methyl]sulfanyl}-7-phenyl-5H-pyrrolo[3,2-d]pyrimidine
4-{[(4-tert-butylphenyl)methyl]sulfanyl}-7-phenyl-5H-pyrrolo[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | C200-9435 |
| Compound Name: | 4-{[(4-tert-butylphenyl)methyl]sulfanyl}-7-phenyl-5H-pyrrolo[3,2-d]pyrimidine |
| Molecular Weight: | 373.52 |
| Molecular Formula: | C23 H23 N3 S |
| Smiles: | CC(C)(C)c1ccc(CSc2c3c(c(c[nH]3)c3ccccc3)ncn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.206 |
| logD: | 6.1942 |
| logSw: | -5.9743 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.0349 |
| InChI Key: | ZCQIFIFWAAMFBR-UHFFFAOYSA-N |