AB00667982-01
TL;DR: AB00667982-01 (CAS 393873-81-9) is a chemical compound with molecular formula C25H21N7O2S2 and molecular weight 515.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide
Also Known As: AB00667982-01, F0508-1399, N-{[5-({[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]methyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}naphthalene-1-carboxamide, N-((5-((2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)-1-naphthamide, N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide
| Molecular Formula | C25H21N7O2S2 |
|---|---|
| Molecular Weight | 515.12 g/mol |
| LogP | 4.24122 |
| Topological Polar Surface Area | 114.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 515.1198 |
| Heavy Atoms | 36 |
| Complexity | 1526.7704 |
Chemical Identifiers
| CAS Number | 393873-81-9 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC=CC5=CC=CC=C54 |
Product Overview
AB00667982-01 (CAS 393873-81-9), with molecular formula C25H21N7O2S2 and molecular weight 515.12 g/mol. IUPAC: N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide.
Chemical Property Profile of AB00667982-01
Property Insights of AB00667982-01
The XLogP value of 4.24122 indicates that AB00667982-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00667982-01. Following Lipinski's Rule of Five, AB00667982-01 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00667982-01?
The CAS number of AB00667982-01 is 393873-81-9.
What is the molecular formula of AB00667982-01?
The molecular formula of AB00667982-01 is C25H21N7O2S2.
What is the molecular weight of AB00667982-01?
The molecular weight of AB00667982-01 is 515.12 g/mol.
Where can I buy AB00667982-01?
You can request a quote for AB00667982-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00667982-01?
Yes, KEHONG BIO provides custom synthesis services for AB00667982-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.