1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-
TL;DR: 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- (CAS 119464-31-2) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-[1-(benzenesulfonyl)pyrrol-3-yl]propan-1-one
Also Known As: 1-Phenylsulfonyl-3-(2-amino)propionylpyrrole, 2-amino-1-[1-(benzenesulfonyl)pyrrol-3-yl]propan-1-one, 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-, 2-amino-1-[1-(phenylsulfonyl)-1h-pyrrol-3-yl]propan-1-one, 1-Propanone,2-amino-1-[1-(phenylsulfonyl)-1H-pyrrol-3-yl]-
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 119464-31-2 |
|---|---|
| SMILES | CC(C(=O)C1=CN(C=C1)S(=O)(=O)C2=CC=CC=C2)N |
| InChIKey | GNUBXIKLLAADKR-UHFFFAOYSA-N |
Product Overview
1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- (CAS 119464-31-2), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 2-amino-1-[1-(benzenesulfonyl)pyrrol-3-yl]propan-1-one.
Chemical Property Profile of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-
Property Insights of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-. Following Lipinski's Rule of Five, 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- has 1 hydrogen bond donor(s) and 4 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 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-?
The CAS number of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- is 119464-31-2.
What is the molecular formula of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-?
The molecular formula of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- is C13H14N2O3S.
What is the molecular weight of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-?
The molecular weight of 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- is 278.07 g/mol.
Where can I buy 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-?
You can request a quote for 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole, 3-(2-amino-1-oxopropyl)-1-(phenylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.