N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-tert-butyl-N-(3-methoxypropyl)benzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-tert-butyl-N-(3-methoxypropyl)benzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-tert-butyl-N-(3-methoxypropyl)benzamide
Compound characteristics
| Compound ID: | V002-9278 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-tert-butyl-N-(3-methoxypropyl)benzamide |
| Molecular Weight: | 610.64 |
| Molecular Formula: | C33 H44 Br N3 O3 |
| Smiles: | CCCCN(Cc1cccn1Cc1ccc(cc1)[Br])C(CN(CCCOC)C(c1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0962 |
| logD: | 7.0962 |
| logSw: | -5.6402 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.774 |
| InChI Key: | QMZOTTNDVHFORH-UHFFFAOYSA-N |