RefChem:267333
TL;DR: RefChem:267333 (CAS 133628-27-0) is a chemical compound with molecular formula C13H20ClN3O3S and molecular weight 333.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-nitro-N-(3-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide;hydrochloride
Also Known As: 2-Thiophenecarboxamide, 5-methyl-4-nitro-N-(3-(1-pyrrolidinyl)propyl)-, monohydrochloride, 2-Methyl-3-nitro-N-(3-pyrrolidin-1-ylpropyl)thiophene-5-carboxamide hydrochloride, 5-Methyl-4-nitro-N-(3-(1-pyrrolidinyl)propyl)-2-thiophenecarboxamide monohydrochloride, 5-methyl-4-nitro-N-(3-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide hydrochloride, 5-Methyl-4-nitro-N-[3-(pyrrolidin-1-yl)propyl]thiophene-2-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C13H20ClN3O3S |
|---|---|
| Molecular Weight | 333.09 g/mol |
| LogP | 2.60222 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.0914 |
| Heavy Atoms | 21 |
| Complexity | 500.85095 |
Chemical Identifiers
| CAS Number | 133628-27-0 |
|---|---|
| SMILES | CC1=C(C=C(S1)C(=O)NCCCN2CCCC2)[N+](=O)[O-].Cl |
Product Overview
RefChem:267333 (CAS 133628-27-0), with molecular formula C13H20ClN3O3S and molecular weight 333.09 g/mol. IUPAC: 5-methyl-4-nitro-N-(3-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide;hydrochloride.
Chemical Property Profile of RefChem:267333
Property Insights of RefChem:267333
The XLogP value of 2.60222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:267333. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:267333. Following Lipinski's Rule of Five, RefChem:267333 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 RefChem:267333?
The CAS number of RefChem:267333 is 133628-27-0.
What is the molecular formula of RefChem:267333?
The molecular formula of RefChem:267333 is C13H20ClN3O3S.
What is the molecular weight of RefChem:267333?
The molecular weight of RefChem:267333 is 333.09 g/mol.
Where can I buy RefChem:267333?
You can request a quote for RefChem:267333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267333?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.