5-(4-tert-butylbenzene-1-sulfonyl)-8-methoxy-2,3-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Chemical Structure Depiction of
5-(4-tert-butylbenzene-1-sulfonyl)-8-methoxy-2,3-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
5-(4-tert-butylbenzene-1-sulfonyl)-8-methoxy-2,3-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Compound characteristics
| Compound ID: | C917-0509 |
| Compound Name: | 5-(4-tert-butylbenzene-1-sulfonyl)-8-methoxy-2,3-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C24 H29 N O5 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(C1C2CC(C)(N(C)C1=O)Oc1ccc(cc12)OC)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4496 |
| logD: | 4.4492 |
| logSw: | -4.5015 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.805 |
| InChI Key: | OIZIOMXXIWTNIG-UHFFFAOYSA-N |