2-amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)-1H-pyrrole-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)-1H-pyrrole-3-carbonitrile
2-amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)-1H-pyrrole-3-carbonitrile
Compound characteristics
| Compound ID: | 8014-1550 |
| Compound Name: | 2-amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)-1H-pyrrole-3-carbonitrile |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C26 H22 F N3 O2 |
| Smiles: | COc1ccc(cc1)c1c(C#N)c(N)n(Cc2ccc(cc2)F)c1c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3512 |
| logD: | 5.3512 |
| logSw: | -5.5537 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.817 |
| InChI Key: | ZTRPNADGQKSKRV-UHFFFAOYSA-N |