Carbobiotin
TL;DR: Carbobiotin (CAS 4474-14-0) is a chemical compound with molecular formula C11H18N2O3 and molecular weight 226.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[d]imidazol-4-yl)pentanoic acid
Also Known As: Carbobiotin, 5-(2-oxooctahydrocyclopenta[d]imidazol-4-yl)pentanoic acid, hexa-hydro-4-(4-carboxybutyl)-2-cyclopentimidazolone, cis-Hexahydro-4-(4-carboxybutyl)-2-cyclopentimidazolone, 5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[d]imidazol-4-yl)pentanoic acid
| Molecular Formula | C11H18N2O3 |
|---|---|
| Molecular Weight | 226.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.13174 |
| Heavy Atoms | 16 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 4474-14-0 |
|---|---|
| SMILES | C1CC2C(C1CCCCC(=O)O)NC(=O)N2 |
| InChIKey | HASKQZMOBUQJPG-UHFFFAOYSA-N |
Product Overview
Carbobiotin (CAS 4474-14-0), with molecular formula C11H18N2O3 and molecular weight 226.13 g/mol. IUPAC: 5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[d]imidazol-4-yl)pentanoic acid.
Chemical Property Profile of Carbobiotin
Property Insights of Carbobiotin
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbobiotin. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbobiotin. Following Lipinski's Rule of Five, Carbobiotin 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 Carbobiotin?
The CAS number of Carbobiotin is 4474-14-0.
What is the molecular formula of Carbobiotin?
The molecular formula of Carbobiotin is C11H18N2O3.
What is the molecular weight of Carbobiotin?
The molecular weight of Carbobiotin is 226.13 g/mol.
Where can I buy Carbobiotin?
You can request a quote for Carbobiotin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbobiotin?
Yes, KEHONG BIO provides custom synthesis services for Carbobiotin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.