2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride
TL;DR: 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride (CAS 669703-53-1) is a chemical compound with molecular formula C13H17N3O2S and molecular weight 279.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-morpholin-4-yl-2-oxoethyl) N'-phenylcarbamimidothioate
Also Known As: 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride, (2-morpholin-4-yl-2-oxoethyl) N'-phenylcarbamimidothioate, 2-morpholin-4-yl-2-oxoethyl N'-phenylimidothiocarbamate hydrochloride, 1-(2-morpholin-4-yl-2-oxo-ethyl)sulfanyl-N'-phenyl-methanimidamide, carbamimidothioic acid, N'-phenyl-, 2-(4-morpholinyl)-2-oxoethyl ester, hydrochloride
| Molecular Formula | C13H17N3O2S |
|---|---|
| Molecular Weight | 279.10 g/mol |
| LogP | 1.2248 |
| Topological Polar Surface Area | 67.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.10416 |
| Heavy Atoms | 19 |
| Complexity | 444.46136 |
Chemical Identifiers
| CAS Number | 669703-53-1 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC(=NC2=CC=CC=C2)N |
Product Overview
2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride (CAS 669703-53-1), with molecular formula C13H17N3O2S and molecular weight 279.10 g/mol. IUPAC: (2-morpholin-4-yl-2-oxoethyl) N'-phenylcarbamimidothioate.
Chemical Property Profile of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride
Property Insights of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride
The XLogP value of 1.2248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride. The TPSA of 67.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride. Following Lipinski's Rule of Five, 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride has 1 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 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride?
The CAS number of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride is 669703-53-1.
What is the molecular formula of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride?
The molecular formula of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride is C13H17N3O2S.
What is the molecular weight of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride?
The molecular weight of 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride is 279.10 g/mol.
Where can I buy 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride?
You can request a quote for 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Morpholino-2-oxoethyl N'-phenylcarbamimidothioate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.