N'-tert-butyl-N-[(furan-2-yl)methyl]-N-{[4-(methoxymethyl)-6-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyrimidin-2-yl]methyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-[(furan-2-yl)methyl]-N-{[4-(methoxymethyl)-6-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyrimidin-2-yl]methyl}urea
N'-tert-butyl-N-[(furan-2-yl)methyl]-N-{[4-(methoxymethyl)-6-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyrimidin-2-yl]methyl}urea
Compound characteristics
| Compound ID: | V004-1233 |
| Compound Name: | N'-tert-butyl-N-[(furan-2-yl)methyl]-N-{[4-(methoxymethyl)-6-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyrimidin-2-yl]methyl}urea |
| Molecular Weight: | 506.52 |
| Molecular Formula: | C25 H29 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CC1NC(C(Cc2cccc(c2)C(F)(F)F)=C(COC)N=1)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8751 |
| logD: | 3.8741 |
| logSw: | -4.1396 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.509 |
| InChI Key: | YCDTXLDQQASQEF-UHFFFAOYSA-N |