N-[(2,5-dimethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
N-[(2,5-dimethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F821-0284 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C23 H27 N3 O7 S |
| Smiles: | COc1ccc(c(CNC(C2CCCN(C2)S(c2ccc3c(c2)NC(CO3)=O)(=O)=O)=O)c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3945 |
| logD: | 1.3943 |
| logSw: | -2.5171 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.741 |
| InChI Key: | LSMORFUWDBAGSR-HNNXBMFYSA-N |