细交链孢菌酮酸
TL;DR: 细交链孢菌酮酸 (CAS 27778-66-1) is a chemical compound with molecular formula C10H15NO3 and molecular weight 197.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
细交链孢菌酮酸
1-(5-butan-2-yl-2,4-dihydroxy-1H-pyrrol-3-yl)ethanone
Also Known As: L-Tenuazonic acid, Pyrrole-2,4-diol, 3-acetyl-5-sec-butyl-, 2,4-Pyrrolidinedione, 3-acetyl-5-sec-butyl-, 3-Acetyl-2,4-dihydroxy-5-(1-methylpropyl)pyrrole, 5-21-11-00555 (Beilstein Handbook Reference)
| Molecular Formula | C10H15NO3 |
|---|---|
| Molecular Weight | 197.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 73.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.1052 |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 27778-66-1 |
|---|---|
| SMILES | CCC(C)C1=C(C(=C(N1)O)C(=O)C)O |
| InChIKey | BBSRHOHIYMGKJH-UHFFFAOYSA-N |
Product Overview
细交链孢菌酮酸 (CAS 27778-66-1), with molecular formula C10H15NO3 and molecular weight 197.11 g/mol. IUPAC: 1-(5-butan-2-yl-2,4-dihydroxy-1H-pyrrol-3-yl)ethanone.
Chemical Property Profile of 细交链孢菌酮酸
Property Insights of 细交链孢菌酮酸
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 细交链孢菌酮酸. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 细交链孢菌酮酸. Following Lipinski's Rule of Five, 细交链孢菌酮酸 has 3 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 细交链孢菌酮酸?
The CAS number of 细交链孢菌酮酸 is 27778-66-1.
What is the molecular formula of 细交链孢菌酮酸?
The molecular formula of 细交链孢菌酮酸 is C10H15NO3.
What is the molecular weight of 细交链孢菌酮酸?
The molecular weight of 细交链孢菌酮酸 is 197.11 g/mol.
Where can I buy 细交链孢菌酮酸?
You can request a quote for 细交链孢菌酮酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 细交链孢菌酮酸?
Yes, KEHONG BIO provides custom synthesis services for 细交链孢菌酮酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.