5-bromo-N-[(5,7-dimethyl-6-{3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl}[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[(5,7-dimethyl-6-{3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl}[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]furan-2-carboxamide
5-bromo-N-[(5,7-dimethyl-6-{3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl}[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | C908-0514 |
| Compound Name: | 5-bromo-N-[(5,7-dimethyl-6-{3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl}[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 518.39 |
| Molecular Formula: | C20 H20 Br N7 O3 S |
| Smiles: | Cc1csc(NC(CCc2c(C)nc3nc(CNC(c4ccc(o4)[Br])=O)nn3c2C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2553 |
| logD: | 2.2395 |
| logSw: | -2.821 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.436 |
| InChI Key: | CEMLBINALPGNBR-UHFFFAOYSA-N |