4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-
TL;DR: 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- (CAS 36017-43-3) is a chemical compound with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4S)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid
Also Known As: BAS 02561397, 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-, [(4S)-1-Benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid, 2-[(4S)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid
| Molecular Formula | C12H12N2O3S |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.05685 |
| Heavy Atoms | 18 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 36017-43-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)[C@@H](NC2=S)CC(=O)O |
| InChIKey | AMROWGDRHJNHAR-VIFPVBQESA-N |
Product Overview
4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- (CAS 36017-43-3), with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol. IUPAC: 2-[(4S)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid.
Chemical Property Profile of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-
Property Insights of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-. Following Lipinski's Rule of Five, 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- has 2 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-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-?
The CAS number of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- is 36017-43-3.
What is the molecular formula of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-?
The molecular formula of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- is C12H12N2O3S.
What is the molecular weight of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-?
The molecular weight of 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- is 264.06 g/mol.
Where can I buy 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-?
You can request a quote for 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Imidazolidineacetic acid, 5-oxo-1-(phenylmethyl)-2-thioxo-, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.