N-(2,5-dimethylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(2,5-dimethylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0537 |
| Compound Name: | N-(2,5-dimethylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)NC(CSc1c2c(c3cc(ccc3[nH]2)OC)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4593 |
| logD: | 3.4581 |
| logSw: | -3.7871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.495 |
| InChI Key: | RTTFDYOXLKLDNE-UHFFFAOYSA-N |