1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
TL;DR: 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione (CAS 190723-14-9) is a chemical compound with molecular formula C10H9Br2NO2S and molecular weight 364.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibromo-5-butylthieno[3,4-c]pyrrole-4,6-dione
Also Known As: 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione, 1,3-dibromo-5-butylthieno[3,4-c]pyrrole-4,6-dione, NCI60_036542, 4H-Thieno[3,4-c]pyrrole-4,6(5H)-dione, 1,3-dibromo-5-butyl-, 1,3-dibromo-5-butyl-thieno[3,4-c]pyrrole-4,6-dione
| Molecular Formula | C10H9Br2NO2S |
|---|---|
| Molecular Weight | 364.87 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.87207 |
| Heavy Atoms | 16 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 190723-14-9 |
|---|---|
| SMILES | CCCCN1C(=O)C2=C(SC(=C2C1=O)Br)Br |
| InChIKey | QIEDHDBRHPTGIL-UHFFFAOYSA-N |
Product Overview
1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione (CAS 190723-14-9), with molecular formula C10H9Br2NO2S and molecular weight 364.87 g/mol. IUPAC: 1,3-dibromo-5-butylthieno[3,4-c]pyrrole-4,6-dione.
Chemical Property Profile of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
Property Insights of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
The XLogP value of 3.9 indicates that 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione. Following Lipinski's Rule of Five, 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione has 0 hydrogen bond donor(s) and 3 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 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione?
The CAS number of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione is 190723-14-9.
What is the molecular formula of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione?
The molecular formula of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione is C10H9Br2NO2S.
What is the molecular weight of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione?
The molecular weight of 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione is 364.87 g/mol.
Where can I buy 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione?
You can request a quote for 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibromo-5-butyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.