d-Sydnocarb
TL;DR: d-Sydnocarb (CAS 78512-16-0) is a chemical compound with molecular formula C18H18N4O2 and molecular weight 322.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-N'-[3-[(2S)-1-phenylpropan-2-yl]oxadiazol-3-ium-5-yl]carbamimidate
Also Known As: Mesocarb, d-Sydnocarb, (S)-mesocarb, N-phenyl-N'-[3-[(2S)-1-phenylpropan-2-yl]oxadiazol-3-ium-5-yl]carbamimidate, (S)-3-(1-Methyl-2-phenylethyl)-5-[[(phenylamino)carbonyl]amino]-1,2,3-oxadiazolium Inner Salt; 3-[(1S)-1-Methyl-2-phenylethyl]-5-[[(phenylamino)carbonyl]amino]-1,2,3-oxadiazolium Inner Salt
| Molecular Formula | C18H18N4O2 |
|---|---|
| Molecular Weight | 322.14 g/mol |
| LogP | 2.2257 |
| Topological Polar Surface Area | 77.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.14297 |
| Heavy Atoms | 24 |
| Complexity | 800.1557 |
Chemical Identifiers
| CAS Number | 78512-16-0 |
|---|---|
| SMILES | C[C@@H](CC1=CC=CC=C1)[N+]2=NOC(=C2)N=C(NC3=CC=CC=C3)[O-] |
Product Overview
d-Sydnocarb (CAS 78512-16-0), with molecular formula C18H18N4O2 and molecular weight 322.14 g/mol. IUPAC: N-phenyl-N'-[3-[(2S)-1-phenylpropan-2-yl]oxadiazol-3-ium-5-yl]carbamimidate.
Chemical Property Profile of d-Sydnocarb
Property Insights of d-Sydnocarb
The XLogP value of 2.2257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for d-Sydnocarb. The TPSA of 77.36 Ų falls within the moderate polarity range, balancing permeability and solubility for d-Sydnocarb. Following Lipinski's Rule of Five, d-Sydnocarb 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 d-Sydnocarb?
The CAS number of d-Sydnocarb is 78512-16-0.
What is the molecular formula of d-Sydnocarb?
The molecular formula of d-Sydnocarb is C18H18N4O2.
What is the molecular weight of d-Sydnocarb?
The molecular weight of d-Sydnocarb is 322.14 g/mol.
Where can I buy d-Sydnocarb?
You can request a quote for d-Sydnocarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for d-Sydnocarb?
Yes, KEHONG BIO provides custom synthesis services for d-Sydnocarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.