N-(3-chloro-4-methylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(3-chloro-4-methylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0539 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 412.9 |
| Molecular Formula: | C20 H17 Cl N4 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1c2c(c3cc(ccc3[nH]2)OC)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8083 |
| logD: | 4.8069 |
| logSw: | -4.9053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.193 |
| InChI Key: | UKNGQRZBVAZCPL-UHFFFAOYSA-N |