6-chloro-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
6-chloro-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
6-chloro-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | L310-0010 |
| Compound Name: | 6-chloro-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 466.94 |
| Molecular Formula: | C20 H23 Cl N4 O5 S |
| Smiles: | Cc1nc(CN2C(COc3cc(c(cc23)[Cl])S(NCCC2CCCCC=2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.8592 |
| logD: | 2.8591 |
| logSw: | -3.5576 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.027 |
| InChI Key: | HVIGUIJCGBROPS-UHFFFAOYSA-N |