2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | M060-0436 |
| Compound Name: | 2-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 431.28 |
| Molecular Formula: | C18 H12 Br F N4 O S |
| Smiles: | C(C(Nc1ccc(cc1)F)=O)Sc1c2c(c3cc(ccc3[nH]2)[Br])ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.1428 |
| logD: | 4.1417 |
| logSw: | -4.316 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.649 |
| InChI Key: | HQNLUWPRSILZCR-UHFFFAOYSA-N |