ethyl 4-{[2-(3-hydroxypropyl)-5-methyl-7-(3-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[2-(3-hydroxypropyl)-5-methyl-7-(3-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl]amino}benzoate
ethyl 4-{[2-(3-hydroxypropyl)-5-methyl-7-(3-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 5223-8306 |
| Compound Name: | ethyl 4-{[2-(3-hydroxypropyl)-5-methyl-7-(3-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1C(c2cccc(C)c2)n2c(NC=1C)nc(CCCO)n2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9027 |
| logD: | 3.8824 |
| logSw: | -3.9548 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.54 |
| InChI Key: | BNKGUYOTNGUOTH-QHCPKHFHSA-N |