N-(cyclopropylmethyl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
N-(cyclopropylmethyl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V028-6084 |
| Compound Name: | N-(cyclopropylmethyl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide |
| Molecular Weight: | 439.57 |
| Molecular Formula: | C26 H34 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(CC2CC2)C(c2ccc(cc2)F)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2416 |
| logD: | 5.2287 |
| logSw: | -5.1038 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.354 |
| InChI Key: | UBNBDZZLURTRRU-UHFFFAOYSA-N |