3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2
TL;DR: 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 (CAS 65800-34-2) is a chemical compound with molecular formula C26H21Cl2NO2 and molecular weight 449.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dichloro-6-(N-phenylanilino)-3-oxatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),11,13-tetraen-4-one
Also Known As: 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2, 3,3-Dichloro-4-(diphenylamino)-4,5,6,7-tetrahydrobenzo[6,7]cyclohepta[1,2-b]pyran-2(3H)-one, 5,5-dichloro-6-(N-phenylanilino)-3-oxatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),11,13-tetraen-4-one
| Molecular Formula | C26H21Cl2NO2 |
|---|---|
| Molecular Weight | 449.09 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.09494 |
| Heavy Atoms | 31 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 65800-34-2 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C3=C(C1)C(C(C(=O)O3)(Cl)Cl)N(C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | UGNUMWVKLSXPCG-UHFFFAOYSA-N |
Product Overview
3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 (CAS 65800-34-2), with molecular formula C26H21Cl2NO2 and molecular weight 449.09 g/mol. IUPAC: 5,5-dichloro-6-(N-phenylanilino)-3-oxatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),11,13-tetraen-4-one.
Chemical Property Profile of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2
Property Insights of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2
The XLogP value of 6.7 indicates that 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2?
The CAS number of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 is 65800-34-2.
What is the molecular formula of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2?
The molecular formula of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 is C26H21Cl2NO2.
What is the molecular weight of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2?
The molecular weight of 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 is 449.09 g/mol.
Where can I buy 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2?
You can request a quote for 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dichloro-4-(N-phenylanilino)-4,5,6,7-tetrahydrobenzo[1,2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.