N-(4-chloro-2-fluorophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(4-chloro-2-fluorophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0279 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 404.82 |
| Molecular Formula: | C18 H11 Cl F2 N4 O S |
| Smiles: | C(C(Nc1ccc(cc1F)[Cl])=O)Sc1c2c(c3cc(ccc3[nH]2)F)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.0803 |
| logD: | 4.0703 |
| logSw: | -4.5087 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.951 |
| InChI Key: | QWELDYPQYCCCRC-UHFFFAOYSA-N |