3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione
TL;DR: 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione (CAS 303034-16-4) is a chemical compound with molecular formula C17H11ClN2O4 and molecular weight 342.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione
Also Known As: BIM-0047049.P001, AE-641/14043057, F0919-2321, 3-(1,3-benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione, 3-(1,3-benzodioxol-5-ylamino)-4-chloro-1-phenyl-1H-pyrrole-2,5-dione
| Molecular Formula | C17H11ClN2O4 |
|---|---|
| Molecular Weight | 342.04 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.04074 |
| Heavy Atoms | 24 |
| Complexity | 573.0 |
Chemical Identifiers
| CAS Number | 303034-16-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC3=C(C(=O)N(C3=O)C4=CC=CC=C4)Cl |
| InChIKey | ONCDZVNRKJIJQM-UHFFFAOYSA-N |
Product Overview
3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione (CAS 303034-16-4), with molecular formula C17H11ClN2O4 and molecular weight 342.04 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione.
Chemical Property Profile of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione
Property Insights of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione
The XLogP value of 3.4 indicates that 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione. Following Lipinski's Rule of Five, 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione has 1 hydrogen bond donor(s) and 5 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-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione?
The CAS number of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione is 303034-16-4.
What is the molecular formula of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione?
The molecular formula of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione is C17H11ClN2O4.
What is the molecular weight of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione?
The molecular weight of 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione is 342.04 g/mol.
Where can I buy 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione?
You can request a quote for 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Benzodioxol-5-ylamino)-4-chloro-1-phenylpyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.