4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid
TL;DR: 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid (CAS 669-72-7) is a chemical compound with molecular formula C9H14N2O3S and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]butanoic acid
Also Known As: NORBIOTIN, 4-(2-Oxo-Hexahydro-Thieno[3,4-D]Imidazol-4-Yl)-Butyricacid, 4-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-4-YL)-BUTYRIC ACID, 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid, 4-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]butanoic acid
| Molecular Formula | C9H14N2O3S |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.07251 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 669-72-7 |
|---|---|
| SMILES | C1[C@H]2[C@@H]([C@@H](S1)CCCC(=O)O)NC(=O)N2 |
| InChIKey | AINAXQHKYSZESH-HAFWLYHUSA-N |
Product Overview
4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid (CAS 669-72-7), with molecular formula C9H14N2O3S and molecular weight 230.07 g/mol. IUPAC: 4-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]butanoic acid.
Chemical Property Profile of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid
Property Insights of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid. Following Lipinski's Rule of Five, 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid has 3 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 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid?
The CAS number of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid is 669-72-7.
What is the molecular formula of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid?
The molecular formula of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid is C9H14N2O3S.
What is the molecular weight of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid?
The molecular weight of 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid is 230.07 g/mol.
Where can I buy 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid?
You can request a quote for 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Oxo-Hexahydro-Thieno(3,4-D)Imidazol-4-Yl)-Butyricacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.