N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-thiazole-4-carboxamide
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-thiazole-4-carboxamide
Compound characteristics
Compound ID: | S233-2130 |
Compound Name: | N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-thiazole-4-carboxamide |
Molecular Weight: | 369.48 |
Molecular Formula: | C20 H23 N3 O2 S |
Smiles: | [H][C@@]12CCC[C@]1(CCC(N2Cc1ccccc1)=O)CNC(c1cscn1)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.5494 |
logD: | 2.5494 |
logSw: | -2.6809 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.572 |
InChI Key: | VJQPPZCVVGMCSV-XLIONFOSSA-N |