TL;DR: Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- (CAS 145131-16-4) is a chemical compound with molecular formula C23H29N3O and molecular weight 363.23105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2,6-di(propan-2-yl)phenyl]-3-[2-(1H-indol-3-yl)ethyl]urea
Also Known As: Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)-, N-(2,6-Bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)urea, N(sup 1)-(2-(3-Indolyl)ethyl)-N(sup 2)-(2,6-diisopropylphenyl)urea, 1-[2,6-bis(propan-2-yl)phenyl]-3-[2-(1H-indol-3-yl)ethyl]urea, 1-[2,6-di(propan-2-yl)phenyl]-3-[2-(1H-indol-3-yl)ethyl]urea
| Molecular Formula | C23H29N3O |
| Molecular Weight | 363.23105 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 56.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.23105 Da |
| Heavy Atoms | 27 |
| Complexity | 462.0 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NCCC2=CNC3=CC=CC=C32 |
| InChIKey | FGIOFFUVGJJIRD-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- has 3 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- is 145131-16-4.
The molecular formula of Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- is C23H29N3O.
The molecular weight of Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(2-(1H-indol-3-yl)ethyl)- is 363.23105 g/mol.
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