TL;DR: Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- (CAS 160807-81-8) is a chemical compound with molecular formula C27H22F2N2O and molecular weight 428.17 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-bis[(3-fluorophenyl)-phenylmethyl]urea
Also Known As: N,N'-Bis((3-fluorophenyl)phenylmethyl)urea, 1,3-bis[(3-fluorophenyl)-phenylmethyl]urea, Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)-, 1,3-bis((3-fluorophenyl)(phenyl)methyl)urea, 1,3-bis[(3-fluorophenyl)(phenyl)methyl]urea
| Molecular Formula | C27H22F2N2O |
| Molecular Weight | 428.17 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.17 Da |
| Heavy Atoms | 32 |
| Complexity | 528.0 |
| SMILES | C1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)NC(C3=CC=CC=C3)C4=CC(=CC=C4)F |
| InChIKey | HOFKOZBBHXEODO-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- is 160807-81-8.
The molecular formula of Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- is C27H22F2N2O.
The molecular weight of Urea, N,N'-bis((3-fluorophenyl)phenylmethyl)- is 428.17 g/mol.
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