N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]dodecanamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]dodecanamide
N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]dodecanamide
Compound characteristics
| Compound ID: | V011-5729 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]dodecanamide |
| Molecular Weight: | 571.84 |
| Molecular Formula: | C33 H50 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CCCCCCCCCCCC(N(CCN1CCCC1)CC(N(Cc1ccc(cc1)F)Cc1c(C)ccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7618 |
| logD: | 6.0856 |
| logSw: | -5.6274 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.951 |
| InChI Key: | BUPMZYSZLDNJFT-UHFFFAOYSA-N |