4-[(N-cyclopropyl-3-methylbutanamido)methyl]phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-[(N-cyclopropyl-3-methylbutanamido)methyl]phenyl 4-methoxybenzene-1-sulfonate
4-[(N-cyclopropyl-3-methylbutanamido)methyl]phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V015-5083 |
| Compound Name: | 4-[(N-cyclopropyl-3-methylbutanamido)methyl]phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 417.52 |
| Molecular Formula: | C22 H27 N O5 S |
| Smiles: | CC(C)CC(N(Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.282 |
| logD: | 4.282 |
| logSw: | -4.2152 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.803 |
| InChI Key: | VHJVJNWSOMWJBQ-UHFFFAOYSA-N |