N-[2-(cyclohex-1-en-1-yl)ethyl]-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Compound characteristics
| Compound ID: | C562-1369 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C25 H29 N3 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(NC(Cc1ccccc1)C(NCCC1CCCCC=1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3542 |
| logD: | 3.3541 |
| logSw: | -4.0151 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.153 |
| InChI Key: | BHXIEZYECSPLFI-NRFANRHFSA-N |