C25H31NO2.xC4H4O4
TL;DR: C25H31NO2.xC4H4O4 (CAS 37124-16-6) is a chemical compound with molecular formula C29H35NO6 and molecular weight 493.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;2-piperidin-1-ylethyl 2,2-bis(4-methylphenyl)cyclopropane-1-carboxylate
Also Known As: 2-(PIPERIDIN-1-YL)ETHYL 2,2-BIS(4-METHYLPHENYL)CYCLOPROPANE-1-CARBOXYLATE MALEATE, Cyclopropanecarboxylic acid, 2,2-bis(4-methylphenyl)-, 2-(1-piperidinyl)ethyl ester, (Z)-2-butenedioate
| Molecular Formula | C29H35NO6 |
|---|---|
| Molecular Weight | 493.25 g/mol |
| LogP | 4.35034 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 493.24643 |
| Heavy Atoms | 36 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 37124-16-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(CC2C(=O)OCCN3CCCCC3)C4=CC=C(C=C4)C.C(=CC(=O)O)C(=O)O |
| InChIKey | NWCSOMGCMDODDP-UHFFFAOYSA-N |
Product Overview
C25H31NO2.xC4H4O4 (CAS 37124-16-6), with molecular formula C29H35NO6 and molecular weight 493.25 g/mol. IUPAC: but-2-enedioic acid;2-piperidin-1-ylethyl 2,2-bis(4-methylphenyl)cyclopropane-1-carboxylate.
Chemical Property Profile of C25H31NO2.xC4H4O4
Property Insights of C25H31NO2.xC4H4O4
The XLogP value of 4.35034 indicates that C25H31NO2.xC4H4O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H31NO2.xC4H4O4. Following Lipinski's Rule of Five, C25H31NO2.xC4H4O4 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C25H31NO2.xC4H4O4?
The CAS number of C25H31NO2.xC4H4O4 is 37124-16-6.
What is the molecular formula of C25H31NO2.xC4H4O4?
The molecular formula of C25H31NO2.xC4H4O4 is C29H35NO6.
What is the molecular weight of C25H31NO2.xC4H4O4?
The molecular weight of C25H31NO2.xC4H4O4 is 493.25 g/mol.
Where can I buy C25H31NO2.xC4H4O4?
You can request a quote for C25H31NO2.xC4H4O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H31NO2.xC4H4O4?
Yes, KEHONG BIO provides custom synthesis services for C25H31NO2.xC4H4O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.