N-(3-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-(1-phenylethyl)nonanamide
Chemical Structure Depiction of
N-(3-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-(1-phenylethyl)nonanamide
N-(3-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-(1-phenylethyl)nonanamide
Compound characteristics
| Compound ID: | V024-4303 |
| Compound Name: | N-(3-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-(1-phenylethyl)nonanamide |
| Molecular Weight: | 536.69 |
| Molecular Formula: | C29 H36 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCCCCCCC(N(CCC(Nc1nnc(c2ccc3c(c2)OCO3)s1)=O)C(C)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2897 |
| logD: | 7.2894 |
| logSw: | -5.559 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.803 |
| InChI Key: | ARIPOXOUCIPRHQ-NRFANRHFSA-N |