N-(3-fluoro-4-methylphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(3-fluoro-4-methylphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0139 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C20 H17 F N4 O S |
| Smiles: | Cc1ccc2c(c1)c1c(c(ncn1)SCC(Nc1ccc(C)c(c1)F)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 4.4976 |
| logD: | 4.4955 |
| logSw: | -4.2359 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.649 |
| InChI Key: | KOWYZPBLBQQJGP-UHFFFAOYSA-N |