1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(thiophen-2-yl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(thiophen-2-yl)methyl]piperidine-4-carboxamide
1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(thiophen-2-yl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-0394 |
| Compound Name: | 1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)-N-[(thiophen-2-yl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 433.96 |
| Molecular Formula: | C21 H24 Cl N3 O3 S |
| Smiles: | CC1CN(C(N2CCC(CC2)C(NCc2cccs2)=O)=O)c2cc(ccc2O1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5668 |
| logD: | 3.5668 |
| logSw: | -3.9171 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.837 |
| InChI Key: | HRUYWLTXKPTOHI-CQSZACIVSA-N |