3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone
TL;DR: 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone (CAS 2341-31-3) is a chemical compound with molecular formula C10H8F2N2O2 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(aziridin-1-yl)-3,6-difluorocyclohexa-2,5-diene-1,4-dione
Also Known As: F-DZQ, TW19, TW 19, 3,6-difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone, 2,5-bis(aziridin-1-yl)-3,6-difluorocyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C10H8F2N2O2 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.05539 |
| Heavy Atoms | 16 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 2341-31-3 |
|---|---|
| SMILES | C1CN1C2=C(C(=O)C(=C(C2=O)F)N3CC3)F |
| InChIKey | SXHRKCIELHYDFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone (CAS 2341-31-3), with molecular formula C10H8F2N2O2 and molecular weight 226.06 g/mol. IUPAC: 2,5-bis(aziridin-1-yl)-3,6-difluorocyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone
Property Insights of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone. With a topological polar surface area (TPSA) of 40.2 Ų, 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone has 0 hydrogen bond donor(s) and 6 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 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone?
The CAS number of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone is 2341-31-3.
What is the molecular formula of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone?
The molecular formula of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone is C10H8F2N2O2.
What is the molecular weight of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone?
The molecular weight of 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone is 226.06 g/mol.
Where can I buy 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone?
You can request a quote for 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Difluoro-2,5-bis(aziridinyl)-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.