C32H29Cl2N3O2
TL;DR: C32H29Cl2N3O2 (CAS 714943-45-0) is a chemical compound with molecular formula C32H29Cl2N3O2 and molecular weight 557.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-6-(4-ethylphenyl)-N-(4-methoxyphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide
Also Known As: 4-(3,4-dichlorophenyl)-1-(4-ethylphenyl)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
| Molecular Formula | C32H29Cl2N3O2 |
|---|---|
| Molecular Weight | 557.16 g/mol |
| LogP | 8.5412 |
| Topological Polar Surface Area | 47.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 557.1637 |
| Heavy Atoms | 39 |
| Complexity | 1681.9784 |
Chemical Identifiers
| CAS Number | 714943-45-0 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC(=C(C=C5)Cl)Cl)C(=O)NC6=CC=C(C=C6)OC |
Product Overview
C32H29Cl2N3O2 (CAS 714943-45-0), with molecular formula C32H29Cl2N3O2 and molecular weight 557.16 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-6-(4-ethylphenyl)-N-(4-methoxyphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide.
Chemical Property Profile of C32H29Cl2N3O2
Property Insights of C32H29Cl2N3O2
The XLogP value of 8.5412 indicates that C32H29Cl2N3O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.67 Ų, C32H29Cl2N3O2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C32H29Cl2N3O2 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C32H29Cl2N3O2?
The CAS number of C32H29Cl2N3O2 is 714943-45-0.
What is the molecular formula of C32H29Cl2N3O2?
The molecular formula of C32H29Cl2N3O2 is C32H29Cl2N3O2.
What is the molecular weight of C32H29Cl2N3O2?
The molecular weight of C32H29Cl2N3O2 is 557.16 g/mol.
Where can I buy C32H29Cl2N3O2?
You can request a quote for C32H29Cl2N3O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C32H29Cl2N3O2?
Yes, KEHONG BIO provides custom synthesis services for C32H29Cl2N3O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.