UPCMLD0ENAT0511-6754:001
TL;DR: UPCMLD0ENAT0511-6754:001 (CAS 721886-31-3) is a chemical compound with molecular formula C29H24Cl2N2O4 and molecular weight 534.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-[4-(2-chloropyridine-3-carbonyl)oxy-3-methylphenyl]propan-2-yl]-2-methylphenyl] 2-chloropyridine-3-carboxylate
Also Known As: UPCMLD0ENAT0511-6754:001, [4-[2-[4-(2-chloropyridine-3-carbonyl)oxy-3-methylphenyl]propan-2-yl]-2-methylphenyl] 2-chloropyridine-3-carboxylate, 4-{2-[4-(2-CHLOROPYRIDINE-3-CARBONYLOXY)-3-METHYLPHENYL]PROPAN-2-YL}-2-METHYLPHENYL 2-CHLOROPYRIDINE-3-CARBOXYLATE
| Molecular Formula | C29H24Cl2N2O4 |
|---|---|
| Molecular Weight | 534.11 g/mol |
| LogP | 7.16454 |
| Topological Polar Surface Area | 78.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.1113 |
| Heavy Atoms | 37 |
| Complexity | 1390.2393 |
Chemical Identifiers
| CAS Number | 721886-31-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)OC(=O)C3=C(N=CC=C3)Cl)C)OC(=O)C4=C(N=CC=C4)Cl |
Product Overview
UPCMLD0ENAT0511-6754:001 (CAS 721886-31-3), with molecular formula C29H24Cl2N2O4 and molecular weight 534.11 g/mol. IUPAC: [4-[2-[4-(2-chloropyridine-3-carbonyl)oxy-3-methylphenyl]propan-2-yl]-2-methylphenyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of UPCMLD0ENAT0511-6754:001
Property Insights of UPCMLD0ENAT0511-6754:001
The XLogP value of 7.16454 indicates that UPCMLD0ENAT0511-6754:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.38 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0511-6754:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0511-6754:001 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 UPCMLD0ENAT0511-6754:001?
The CAS number of UPCMLD0ENAT0511-6754:001 is 721886-31-3.
What is the molecular formula of UPCMLD0ENAT0511-6754:001?
The molecular formula of UPCMLD0ENAT0511-6754:001 is C29H24Cl2N2O4.
What is the molecular weight of UPCMLD0ENAT0511-6754:001?
The molecular weight of UPCMLD0ENAT0511-6754:001 is 534.11 g/mol.
Where can I buy UPCMLD0ENAT0511-6754:001?
You can request a quote for UPCMLD0ENAT0511-6754:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0511-6754:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0511-6754:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.