Pyrrolomycin A
TL;DR: Pyrrolomycin A (CAS 79763-01-2) is a chemical compound with molecular formula C4H2Cl2N2O2 and molecular weight 179.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dichloro-4-nitro-1H-pyrrole
Also Known As: Pyrrolomycin A, PyrrolomycinA, 2,3-Dichloro-4-nitro-1H-pyrrole, Pyrrolmycin-A, 2,3-Dichloro-4-nitropyrrole
| Molecular Formula | C4H2Cl2N2O2 |
|---|---|
| Molecular Weight | 179.95 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.94933 |
| Heavy Atoms | 10 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 79763-01-2 |
|---|---|
| SMILES | C1=C(C(=C(N1)Cl)Cl)[N+](=O)[O-] |
| InChIKey | CDHAYBUDIPNGGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolomycin A (CAS 79763-01-2), with molecular formula C4H2Cl2N2O2 and molecular weight 179.95 g/mol. IUPAC: 2,3-dichloro-4-nitro-1H-pyrrole.
Chemical Property Profile of Pyrrolomycin A
Property Insights of Pyrrolomycin A
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolomycin A. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrrolomycin A. Following Lipinski's Rule of Five, Pyrrolomycin A has 1 hydrogen bond donor(s) and 2 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 Pyrrolomycin A?
The CAS number of Pyrrolomycin A is 79763-01-2.
What is the molecular formula of Pyrrolomycin A?
The molecular formula of Pyrrolomycin A is C4H2Cl2N2O2.
What is the molecular weight of Pyrrolomycin A?
The molecular weight of Pyrrolomycin A is 179.95 g/mol.
Where can I buy Pyrrolomycin A?
You can request a quote for Pyrrolomycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolomycin A?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolomycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.