methyl 1-ethyl-4-[(5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-[(5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-1H-pyrazole-3-carboxylate
methyl 1-ethyl-4-[(5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y502-6327 |
| Compound Name: | methyl 1-ethyl-4-[(5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C16 H20 N4 O4 |
| Smiles: | CCn1cc(c(C(=O)OC)n1)NC(c1c2CC(C)CCc2on1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8037 |
| logD: | -0.2983 |
| logSw: | -2.2594 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.254 |
| InChI Key: | JBWZMKPYWNYMRZ-SECBINFHSA-N |