ChemDiv1_014262
TL;DR: ChemDiv1_014262 (CAS 389072-83-7) is a chemical compound with molecular formula C16H15N7O4S3 and molecular weight 465.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide
Also Known As: ChemDiv1_014262, F0509-2402, N-[5-({[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide, N-(5-((2-((5-ethyl-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide, N-[5-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide
| Molecular Formula | C16H15N7O4S3 |
|---|---|
| Molecular Weight | 465.03 g/mol |
| LogP | 3.15172 |
| Topological Polar Surface Area | 152.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.03476 |
| Heavy Atoms | 30 |
| Complexity | 1098.2065 |
Chemical Identifiers
| CAS Number | 389072-83-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C |
Product Overview
ChemDiv1_014262 (CAS 389072-83-7), with molecular formula C16H15N7O4S3 and molecular weight 465.03 g/mol. IUPAC: N-[5-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide.
Chemical Property Profile of ChemDiv1_014262
Property Insights of ChemDiv1_014262
The XLogP value of 3.15172 indicates that ChemDiv1_014262 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.9 Ų indicates high polarity, suggesting ChemDiv1_014262 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_014262 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_014262?
The CAS number of ChemDiv1_014262 is 389072-83-7.
What is the molecular formula of ChemDiv1_014262?
The molecular formula of ChemDiv1_014262 is C16H15N7O4S3.
What is the molecular weight of ChemDiv1_014262?
The molecular weight of ChemDiv1_014262 is 465.03 g/mol.
Where can I buy ChemDiv1_014262?
You can request a quote for ChemDiv1_014262 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014262?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014262 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.