1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide
1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-0253 |
| Compound Name: | 1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 471.98 |
| Molecular Formula: | C25 H30 Cl N3 O4 |
| Smiles: | CCCOc1ccc(CNC(C2CCN(CC2)C(N2CCOc3ccc(cc23)[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2385 |
| logD: | 4.2385 |
| logSw: | -4.4621 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.139 |
| InChI Key: | RPNPTHGZUBXCRH-UHFFFAOYSA-N |