N-(2,5-dimethoxyphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(2,5-dimethoxyphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0559 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CSc1c2c(c3cc(ccc3[nH]2)OC)ncn1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1015 |
| logD: | 3.0998 |
| logSw: | -3.4394 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.669 |
| InChI Key: | AVIUOJGGAPGMCG-UHFFFAOYSA-N |