2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide
Chemical Structure Depiction of
2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide
2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide
Compound characteristics
| Compound ID: | M060-0498 |
| Compound Name: | 2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide |
| Molecular Weight: | 449.27 |
| Molecular Formula: | C18 H11 Br F2 N4 O S |
| Smiles: | C(C(Nc1ccc(cc1F)F)=O)Sc1c2c(c3cc(ccc3[nH]2)[Br])ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.0296 |
| logD: | 4.0194 |
| logSw: | -4.2287 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.951 |
| InChI Key: | XGOVMXBFSLOTJQ-UHFFFAOYSA-N |