N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-(3-methoxypropyl)-N~2~-[3-(trifluoromethyl)benzene-1-sulfonyl]glycinamide
Chemical Structure Depiction of
N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-(3-methoxypropyl)-N~2~-[3-(trifluoromethyl)benzene-1-sulfonyl]glycinamide
N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-(3-methoxypropyl)-N~2~-[3-(trifluoromethyl)benzene-1-sulfonyl]glycinamide
Compound characteristics
| Compound ID: | V009-8513 |
| Compound Name: | N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-(3-methoxypropyl)-N~2~-[3-(trifluoromethyl)benzene-1-sulfonyl]glycinamide |
| Molecular Weight: | 658.58 |
| Molecular Formula: | C29 H35 Br F3 N3 O4 S |
| Smiles: | CCCCN(Cc1cccn1Cc1ccc(cc1)[Br])C(CN(CCCOC)S(c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3128 |
| logD: | 6.3128 |
| logSw: | -5.5152 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.939 |
| InChI Key: | KUIAYLIXLWTBAY-UHFFFAOYSA-N |