AB00559614-06
TL;DR: AB00559614-06 (CAS 851862-73-2) is a chemical compound with molecular formula C18H20N6O5S3 and molecular weight 496.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]-3,4-dimethoxybenzamide
Also Known As: AB00559614-06, F0623-0806, N-((5-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)-3,4-dimethoxybenzamide, N-({5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)-3,4-dimethoxybenzamide, N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]-3,4-dimethoxybenzamide
| Molecular Formula | C18H20N6O5S3 |
|---|---|
| Molecular Weight | 496.07 g/mol |
| LogP | 2.7111 |
| Topological Polar Surface Area | 141.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 496.06573 |
| Heavy Atoms | 32 |
| Complexity | 1073.0651 |
Chemical Identifiers
| CAS Number | 851862-73-2 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(O2)CNC(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
AB00559614-06 (CAS 851862-73-2), with molecular formula C18H20N6O5S3 and molecular weight 496.07 g/mol. IUPAC: N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of AB00559614-06
Property Insights of AB00559614-06
The XLogP value of 2.7111 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00559614-06. The TPSA of 141.36 Ų indicates high polarity, suggesting AB00559614-06 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00559614-06 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00559614-06?
The CAS number of AB00559614-06 is 851862-73-2.
What is the molecular formula of AB00559614-06?
The molecular formula of AB00559614-06 is C18H20N6O5S3.
What is the molecular weight of AB00559614-06?
The molecular weight of AB00559614-06 is 496.07 g/mol.
Where can I buy AB00559614-06?
You can request a quote for AB00559614-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00559614-06?
Yes, KEHONG BIO provides custom synthesis services for AB00559614-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.