SRI 8453
TL;DR: SRI 8453 (CAS 174654-90-1) is a chemical compound with molecular formula C16H17N5S and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-6-[(3-methylphenyl)sulfanylmethyl]pyrido[2,3-d]pyrimidine-2,4-diamine
Also Known As: SRI 8453, J1.681.896H, 2,4-Diamino-5-methylpyrido(2,3-d)pyrimidine, 6-((3-methylphenylthio)methyl), 0.7 hydrate, 5-METHYL-6-{[(3-METHYLPHENYL)SULFANYL]METHYL}PYRIDO[2,3-D]PYRIMIDINE-2,4-DIAMINE, 5-Methyl-6-(3-methylphenylthiomethyl)pyrido[2,3-d]pyrimidine-2,4-diamine
| Molecular Formula | C16H17N5S |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.12045 |
| Heavy Atoms | 22 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 174654-90-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)SCC2=CN=C3C(=C2C)C(=NC(=N3)N)N |
| InChIKey | MNHWODGSAAWVCT-UHFFFAOYSA-N |
Product Overview
SRI 8453 (CAS 174654-90-1), with molecular formula C16H17N5S and molecular weight 311.12 g/mol. IUPAC: 5-methyl-6-[(3-methylphenyl)sulfanylmethyl]pyrido[2,3-d]pyrimidine-2,4-diamine.
Chemical Property Profile of SRI 8453
Property Insights of SRI 8453
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SRI 8453. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SRI 8453. Following Lipinski's Rule of Five, SRI 8453 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 SRI 8453?
The CAS number of SRI 8453 is 174654-90-1.
What is the molecular formula of SRI 8453?
The molecular formula of SRI 8453 is C16H17N5S.
What is the molecular weight of SRI 8453?
The molecular weight of SRI 8453 is 311.12 g/mol.
Where can I buy SRI 8453?
You can request a quote for SRI 8453 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SRI 8453?
Yes, KEHONG BIO provides custom synthesis services for SRI 8453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.