methyl 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}benzoate
methyl 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | J006-0353 |
| Compound Name: | methyl 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}benzoate |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | Cc1c(C2CCCN2Cc2ccc(cc2)C(=O)OC)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8521 |
| logD: | 1.2268 |
| logSw: | -2.9063 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.137 |
| InChI Key: | RIWGVAKBNFGIGP-INIZCTEOSA-N |