![3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione structure](/static/products/102/1024151-84-5.png)
3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione
TL;DR: 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione (CAS 1024151-84-5) is a chemical compound with molecular formula C21H14Cl2N2O3S and molecular weight 444.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,6-dichlorophenyl)-2-phenyl-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione, 5-(2,6-dichlorophenyl)-2-phenyl-3-(thiophen-2-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, 5-(2,6-dichlorophenyl)-2-phenyl-3-(thiophen-2-yl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(2,6-dichlorophenyl)-2-phenyl-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C21H14Cl2N2O3S |
|---|---|
| Molecular Weight | 444.01 g/mol |
| LogP | 5.106 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.01022 |
| Heavy Atoms | 29 |
| Complexity | 1070.3203 |
Chemical Identifiers
| CAS Number | 1024151-84-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=C(C=CC=C4Cl)Cl)C5=CC=CS5 |
Product Overview
3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione (CAS 1024151-84-5), with molecular formula C21H14Cl2N2O3S and molecular weight 444.01 g/mol. IUPAC: 5-(2,6-dichlorophenyl)-2-phenyl-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione
Property Insights of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione
The XLogP value of 5.106 indicates that 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione?
The CAS number of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione is 1024151-84-5.
What is the molecular formula of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione?
The molecular formula of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione is C21H14Cl2N2O3S.
What is the molecular weight of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione?
The molecular weight of 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione is 444.01 g/mol.
Where can I buy 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione?
You can request a quote for 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-dichlorophenyl)-7-phenyl-8-thiophen-2-yl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.