methyl 4-{[2-(4-methoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butanoate
Chemical Structure Depiction of
methyl 4-{[2-(4-methoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butanoate
methyl 4-{[2-(4-methoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butanoate
Compound characteristics
| Compound ID: | D245-0313 |
| Compound Name: | methyl 4-{[2-(4-methoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butanoate |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C18 H21 N5 O3 |
| Smiles: | Cc1cc(NCCCC(=O)OC)n2c(n1)nc(c1ccc(cc1)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.4486 |
| logD: | 2.3693 |
| logSw: | -2.8452 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.398 |
| InChI Key: | IPBCSGMMYMMNLP-UHFFFAOYSA-N |