N-[2-(3-methylphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(3-methylphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
N-[2-(3-methylphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E245-1711 |
| Compound Name: | N-[2-(3-methylphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | Cc1cccc(CCNC(C2CCN(CC2)S(c2ccc3c(c2)NC(CO3)=O)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.0424 |
| logD: | 2.0421 |
| logSw: | -2.8179 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.474 |
| InChI Key: | LSTDGHMCIVNYBR-UHFFFAOYSA-N |