AB00668302-01
TL;DR: AB00668302-01 (CAS 450346-24-4) is a chemical compound with molecular formula C11H11N7O4S and molecular weight 337.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]-2-oxoethyl]thiophene-2-carboxamide
Also Known As: AB00668302-01, F0543-0299, N-{[N'-(6-AMINO-5-NITROPYRIMIDIN-4-YL)HYDRAZINECARBONYL]METHYL}THIOPHENE-2-CARBOXAMIDE, N-(2-(2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl)-2-oxoethyl)thiophene-2-carboxamide, N-[2-[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]-2-oxoethyl]thiophene-2-carboxamide
| Molecular Formula | C11H11N7O4S |
|---|---|
| Molecular Weight | 337.06 g/mol |
| LogP | -0.0984 |
| Topological Polar Surface Area | 165.17 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.05933 |
| Heavy Atoms | 23 |
| Complexity | 733.98114 |
Chemical Identifiers
| CAS Number | 450346-24-4 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)NCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N |
Product Overview
AB00668302-01 (CAS 450346-24-4), with molecular formula C11H11N7O4S and molecular weight 337.06 g/mol. IUPAC: N-[2-[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]-2-oxoethyl]thiophene-2-carboxamide.
Chemical Property Profile of AB00668302-01
Property Insights of AB00668302-01
The XLogP value of -0.0984 indicates that AB00668302-01 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 165.17 Ų indicates high polarity, suggesting AB00668302-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00668302-01 has 4 hydrogen bond donor(s) and 9 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 AB00668302-01?
The CAS number of AB00668302-01 is 450346-24-4.
What is the molecular formula of AB00668302-01?
The molecular formula of AB00668302-01 is C11H11N7O4S.
What is the molecular weight of AB00668302-01?
The molecular weight of AB00668302-01 is 337.06 g/mol.
Where can I buy AB00668302-01?
You can request a quote for AB00668302-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668302-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668302-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.