NCIOpen2_009365
TL;DR: NCIOpen2_009365 (CAS 93256-96-3) is a chemical compound with molecular formula C13H16N4O4S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-4-methylbenzenesulfonamide
Also Known As: NCIOpen2_009365, n-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-4-methylbenzenesulfonamide, N-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-4-methylben, N-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-4-methylbenzenesulfonamide, N-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-methylbenzenesulfonamide
| Molecular Formula | C13H16N4O4S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.08923 |
| Heavy Atoms | 22 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 93256-96-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(C(=O)N(C2=O)C)C)N |
| InChIKey | QWSLNCBRJJMVNT-UHFFFAOYSA-N |
Product Overview
NCIOpen2_009365 (CAS 93256-96-3), with molecular formula C13H16N4O4S and molecular weight 324.09 g/mol. IUPAC: N-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-4-methylbenzenesulfonamide.
Chemical Property Profile of NCIOpen2_009365
Property Insights of NCIOpen2_009365
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCIOpen2_009365. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCIOpen2_009365. Following Lipinski's Rule of Five, NCIOpen2_009365 has 2 hydrogen bond donor(s) and 6 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 NCIOpen2_009365?
The CAS number of NCIOpen2_009365 is 93256-96-3.
What is the molecular formula of NCIOpen2_009365?
The molecular formula of NCIOpen2_009365 is C13H16N4O4S.
What is the molecular weight of NCIOpen2_009365?
The molecular weight of NCIOpen2_009365 is 324.09 g/mol.
Where can I buy NCIOpen2_009365?
You can request a quote for NCIOpen2_009365 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_009365?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_009365 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.