N-benzyl-N'-{[rel-(4aR,7aS)-1-(cyclohexylmethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}urea
Chemical Structure Depiction of
N-benzyl-N'-{[rel-(4aR,7aS)-1-(cyclohexylmethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}urea
N-benzyl-N'-{[rel-(4aR,7aS)-1-(cyclohexylmethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}urea
Compound characteristics
| Compound ID: | S233-1666 |
| Compound Name: | N-benzyl-N'-{[rel-(4aR,7aS)-1-(cyclohexylmethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}urea |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C24 H35 N3 O2 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CC1CCCCC1)=O)CNC(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7163 |
| logD: | 3.7163 |
| logSw: | -4.0388 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.67 |
| InChI Key: | KLAHABSTGOOVFY-QPPBQGQZSA-N |