N-[4-(propan-2-yl)phenyl]-2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-(propan-2-yl)phenyl]-2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-[4-(propan-2-yl)phenyl]-2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0048 |
| Compound Name: | N-[4-(propan-2-yl)phenyl]-2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1c2c(c3ccccc3[nH]2)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7172 |
| logD: | 4.7163 |
| logSw: | -4.6448 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.649 |
| InChI Key: | GEYCITLDDJEQFC-UHFFFAOYSA-N |