AB00587002-06
TL;DR: AB00587002-06 (CAS 851861-41-1) is a chemical compound with molecular formula C18H16N4O3S2 and molecular weight 400.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide
Also Known As: AB00587002-06, F0623-0451, N-((5-((2-(indolin-1-yl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)thiophene-2-carboxamide, N-[(5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]thio}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide, N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide
| Molecular Formula | C18H16N4O3S2 |
|---|---|
| Molecular Weight | 400.07 g/mol |
| LogP | 2.7425 |
| Topological Polar Surface Area | 88.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.06638 |
| Heavy Atoms | 27 |
| Complexity | 955.18964 |
Chemical Identifiers
| CAS Number | 851861-41-1 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)CSC3=NN=C(O3)CNC(=O)C4=CC=CS4 |
Product Overview
AB00587002-06 (CAS 851861-41-1), with molecular formula C18H16N4O3S2 and molecular weight 400.07 g/mol. IUPAC: N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide.
Chemical Property Profile of AB00587002-06
Property Insights of AB00587002-06
The XLogP value of 2.7425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00587002-06. The TPSA of 88.33 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00587002-06. Following Lipinski's Rule of Five, AB00587002-06 has 1 hydrogen bond donor(s) and 7 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 AB00587002-06?
The CAS number of AB00587002-06 is 851861-41-1.
What is the molecular formula of AB00587002-06?
The molecular formula of AB00587002-06 is C18H16N4O3S2.
What is the molecular weight of AB00587002-06?
The molecular weight of AB00587002-06 is 400.07 g/mol.
Where can I buy AB00587002-06?
You can request a quote for AB00587002-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00587002-06?
Yes, KEHONG BIO provides custom synthesis services for AB00587002-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.