rel-(3R,4S)-4-[1-(1-ethyl-1H-pyrazole-5-carbonyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
Chemical Structure Depiction of
rel-(3R,4S)-4-[1-(1-ethyl-1H-pyrazole-5-carbonyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
rel-(3R,4S)-4-[1-(1-ethyl-1H-pyrazole-5-carbonyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
Compound characteristics
| Compound ID: | S756-0074 |
| Compound Name: | rel-(3R,4S)-4-[1-(1-ethyl-1H-pyrazole-5-carbonyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C23 H28 N4 O4 |
| Smiles: | CCn1c(ccn1)C(N1CCC(=CC1)[C@H]1[C@H](C(N1Cc1ccc(cc1)OC)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2511 |
| logD: | 1.2511 |
| logSw: | -1.9168 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.478 |
| InChI Key: | AQOVQGPBKXBJCT-LEWJYISDSA-N |