BAS 13118195
TL;DR: BAS 13118195 (CAS 354544-01-7) is a chemical compound with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1,3-dimethyl-5-(thiophen-2-ylmethyliminomethyl)pyrimidine-2,4-dione
Also Known As: BAS 13118195, BIM-0028122.P001, 1,3-dimethyl-5-(((thiophen-2-ylmethyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-dimethyl-5-[(thiophen-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione, 1,3-dimethyl-5-{[(2-thienylmethyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C12H13N3O3S |
|---|---|
| Molecular Weight | 279.07 g/mol |
| LogP | 0.4702 |
| Topological Polar Surface Area | 76.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.06775 |
| Heavy Atoms | 19 |
| Complexity | 725.9084 |
Chemical Identifiers
| CAS Number | 354544-01-7 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)C=NCC2=CC=CS2)O |
Product Overview
BAS 13118195 (CAS 354544-01-7), with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol. IUPAC: 6-hydroxy-1,3-dimethyl-5-(thiophen-2-ylmethyliminomethyl)pyrimidine-2,4-dione.
Chemical Property Profile of BAS 13118195
Property Insights of BAS 13118195
The XLogP value of 0.4702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13118195. The TPSA of 76.59 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13118195. Following Lipinski's Rule of Five, BAS 13118195 has 1 hydrogen bond donor(s) and 5 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 BAS 13118195?
The CAS number of BAS 13118195 is 354544-01-7.
What is the molecular formula of BAS 13118195?
The molecular formula of BAS 13118195 is C12H13N3O3S.
What is the molecular weight of BAS 13118195?
The molecular weight of BAS 13118195 is 279.07 g/mol.
Where can I buy BAS 13118195?
You can request a quote for BAS 13118195 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13118195?
Yes, KEHONG BIO provides custom synthesis services for BAS 13118195 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.