2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M060-0102 |
| Compound Name: | 2-[(5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 402.4 |
| Molecular Formula: | C19 H13 F3 N4 O S |
| Smiles: | C(C(Nc1ccc(cc1)C(F)(F)F)=O)Sc1c2c(c3ccccc3[nH]2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2518 |
| logD: | 4.2508 |
| logSw: | -4.462 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.649 |
| InChI Key: | CLBTXIBJLJQCML-UHFFFAOYSA-N |