N-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(3,4,5-trimethoxyphenyl)urea
Chemical Structure Depiction of
N-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(3,4,5-trimethoxyphenyl)urea
N-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(3,4,5-trimethoxyphenyl)urea
Compound characteristics
| Compound ID: | G331-0199 |
| Compound Name: | N-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(3,4,5-trimethoxyphenyl)urea |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C22 H24 F N3 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(NCc1cccn1Cc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3121 |
| logD: | 3.3121 |
| logSw: | -3.5481 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.912 |
| InChI Key: | HRMQMQLFLYQWMW-UHFFFAOYSA-N |