b4cHCaAdCP
TL;DR: b4cHCaAdCP (CAS 75414-72-1) is a chemical compound with molecular formula C30H40N2O4 and molecular weight 492.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyanophenyl] 4-butylcyclohexane-1-carboxylate
Also Known As: b4cHCaAdCP, BAS 00395995, 4-butyl-Cyclohexanecarboxylic acid 2,3-dicyano-1,4-phenylene ester, [4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyanophenyl] 4-butylcyclohexane-1-carboxylate, [trans(trans)]-4-Butylcyclohexanecarboxylicacid2,3-dicyano-1,4-phenyleneester
| Molecular Formula | C30H40N2O4 |
|---|---|
| Molecular Weight | 492.30 g/mol |
| LogP | 7.23396 |
| Topological Polar Surface Area | 100.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 492.2988 |
| Heavy Atoms | 36 |
| Complexity | 894.8886 |
Chemical Identifiers
| CAS Number | 75414-72-1 |
|---|---|
| SMILES | CCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3CCC(CC3)CCCC)C#N)C#N |
Product Overview
b4cHCaAdCP (CAS 75414-72-1), with molecular formula C30H40N2O4 and molecular weight 492.30 g/mol. IUPAC: [4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyanophenyl] 4-butylcyclohexane-1-carboxylate.
Chemical Property Profile of b4cHCaAdCP
Property Insights of b4cHCaAdCP
The XLogP value of 7.23396 indicates that b4cHCaAdCP is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.18 Ų falls within the moderate polarity range, balancing permeability and solubility for b4cHCaAdCP. Following Lipinski's Rule of Five, b4cHCaAdCP has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of b4cHCaAdCP?
The CAS number of b4cHCaAdCP is 75414-72-1.
What is the molecular formula of b4cHCaAdCP?
The molecular formula of b4cHCaAdCP is C30H40N2O4.
What is the molecular weight of b4cHCaAdCP?
The molecular weight of b4cHCaAdCP is 492.30 g/mol.
Where can I buy b4cHCaAdCP?
You can request a quote for b4cHCaAdCP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for b4cHCaAdCP?
Yes, KEHONG BIO provides custom synthesis services for b4cHCaAdCP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.