N-(2,3-dimethylphenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(2,3-dimethylphenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0287 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C20 H17 F N4 O S |
| Smiles: | Cc1cccc(c1C)NC(CSc1c2c(c3cc(ccc3[nH]2)F)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0889 |
| logD: | 4.0883 |
| logSw: | -4.1799 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.951 |
| InChI Key: | ZOSQUTNFHWBCEA-UHFFFAOYSA-N |