RefChem:316057
TL;DR: RefChem:316057 (CAS 95546-92-2) is a chemical compound with molecular formula C11H17N5OS and molecular weight 267.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(dimethylamino)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide
Also Known As: (6-Dimethylaminopyrimidin-4-ylthio)acetoisopropylidenehydrazide, Acetic acid, ((6-(dimethylamino)-4-pyrimidinyl)thio)-, (1-methylethylidene)hydrazide, ((6-(Dimethylamino)-4-pyrimidinyl)thio)acetic acid (1-methylethylidene)hydrazide, 2-[6-(dimethylamino)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide, 2-[6-(dimethylamino)pyrimidin-4-ylthio]-N-(2-methyl-1-azaprop-1-enyl)acetamide
| Molecular Formula | C11H17N5OS |
|---|---|
| Molecular Weight | 267.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 95.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.1154 |
| Heavy Atoms | 18 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 95546-92-2 |
|---|---|
| SMILES | CC(=NNC(=O)CSC1=NC=NC(=C1)N(C)C)C |
| InChIKey | SSYGESOAPOIYOP-UHFFFAOYSA-N |
Product Overview
RefChem:316057 (CAS 95546-92-2), with molecular formula C11H17N5OS and molecular weight 267.12 g/mol. IUPAC: 2-[6-(dimethylamino)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide.
Chemical Property Profile of RefChem:316057
Property Insights of RefChem:316057
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:316057. The TPSA of 95.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316057. Following Lipinski's Rule of Five, RefChem:316057 has 1 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 RefChem:316057?
The CAS number of RefChem:316057 is 95546-92-2.
What is the molecular formula of RefChem:316057?
The molecular formula of RefChem:316057 is C11H17N5OS.
What is the molecular weight of RefChem:316057?
The molecular weight of RefChem:316057 is 267.12 g/mol.
Where can I buy RefChem:316057?
You can request a quote for RefChem:316057 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316057?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.