3-{[2-(benzylcarbamamido)ethyl](oxan-4-yl)amino}-N,N-dimethylpyrrolidine-1-carboxamide
Chemical Structure Depiction of
3-{[2-(benzylcarbamamido)ethyl](oxan-4-yl)amino}-N,N-dimethylpyrrolidine-1-carboxamide
3-{[2-(benzylcarbamamido)ethyl](oxan-4-yl)amino}-N,N-dimethylpyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB04-0527 |
| Compound Name: | 3-{[2-(benzylcarbamamido)ethyl](oxan-4-yl)amino}-N,N-dimethylpyrrolidine-1-carboxamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C22 H35 N5 O3 |
| Smiles: | CN(C)C(N1CCC(C1)N(CCNC(NCc1ccccc1)=O)C1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1445 |
| logD: | -4.0165 |
| logSw: | -1.6544 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.921 |
| InChI Key: | BTIGPACHTHWZRO-HXUWFJFHSA-N |