Metomidate, (S)-
TL;DR: Metomidate, (S)- (CAS 61045-95-2) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate
Also Known As: (S)-Metomidate, Metomidate, (S)-, (-)-Metomidate, Metomidate, (-)-, Metomidate
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.279 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 505.14783 |
Chemical Identifiers
| CAS Number | 61045-95-2 |
|---|---|
| SMILES | C[C@@H](C1=CC=CC=C1)N2C=NC=C2C(=O)OC |
Product Overview
Metomidate, (S)- (CAS 61045-95-2), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: methyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate.
Chemical Property Profile of Metomidate, (S)-
Property Insights of Metomidate, (S)-
The XLogP value of 2.279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Metomidate, (S)-. With a topological polar surface area (TPSA) of 44.12 Ų, Metomidate, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metomidate, (S)- has 0 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 Metomidate, (S)-?
The CAS number of Metomidate, (S)- is 61045-95-2.
What is the molecular formula of Metomidate, (S)-?
The molecular formula of Metomidate, (S)- is C13H14N2O2.
What is the molecular weight of Metomidate, (S)-?
The molecular weight of Metomidate, (S)- is 230.11 g/mol.
Where can I buy Metomidate, (S)-?
You can request a quote for Metomidate, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metomidate, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Metomidate, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.