U 35,777A
TL;DR: U 35,777A (CAS 42020-96-2) is a chemical compound with molecular formula C23H28ClF2NO2 and molecular weight 423.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-[[4-(4-fluorophenyl)-4-methoxycyclohexyl]amino]butan-1-one;hydrochloride
Also Known As: 6,7-Dimethyl-indol, U 35777A, U 35,777A, U-35777A, U-35,777A
| Molecular Formula | C23H28ClF2NO2 |
|---|---|
| Molecular Weight | 423.18 g/mol |
| LogP | 5.4236 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.17767 |
| Heavy Atoms | 29 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 42020-96-2 |
|---|---|
| SMILES | COC1(CCC(CC1)NCCCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl |
| InChIKey | SIZQOZWQHVSXMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
U 35,777A (CAS 42020-96-2), with molecular formula C23H28ClF2NO2 and molecular weight 423.18 g/mol. IUPAC: 1-(4-fluorophenyl)-4-[[4-(4-fluorophenyl)-4-methoxycyclohexyl]amino]butan-1-one;hydrochloride.
Chemical Property Profile of U 35,777A
Property Insights of U 35,777A
The XLogP value of 5.4236 indicates that U 35,777A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, U 35,777A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, U 35,777A has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of U 35,777A?
The CAS number of U 35,777A is 42020-96-2.
What is the molecular formula of U 35,777A?
The molecular formula of U 35,777A is C23H28ClF2NO2.
What is the molecular weight of U 35,777A?
The molecular weight of U 35,777A is 423.18 g/mol.
Where can I buy U 35,777A?
You can request a quote for U 35,777A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U 35,777A?
Yes, KEHONG BIO provides custom synthesis services for U 35,777A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.