N-(2,4-difluorophenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
N-(2,4-difluorophenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M060-0589 |
| Compound Name: | N-(2,4-difluorophenyl)-2-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 400.4 |
| Molecular Formula: | C19 H14 F2 N4 O2 S |
| Smiles: | COc1ccc2c(c1)c1c(c(ncn1)SCC(Nc1ccc(cc1F)F)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.334 |
| logD: | 3.3235 |
| logSw: | -3.684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.495 |
| InChI Key: | QIJPKOMDCTVTKM-UHFFFAOYSA-N |