N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | C534-0508 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | C1CCC(CCNC(CN2C(COc3ccc(cc23)S(N2CCCC2)(=O)=O)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.9671 |
| logD: | 1.9671 |
| logSw: | -2.7986 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.65 |
| InChI Key: | KSXNREOHZRYROK-UHFFFAOYSA-N |