BAS 11216129
TL;DR: BAS 11216129 (CAS 890641-93-7) is a chemical compound with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1,3-dimethyl-5-[(5-methyl-4-phenyl-1H-pyrazol-3-yl)iminomethyl]pyrimidine-2,4-dione
Also Known As: BAS 11216129, 1,3-dimethyl-5-{[(3-methyl-4-phenyl-1H-pyrazol-5-yl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-dimethyl-5-(((3-methyl-4-phenyl-1H-pyrazol-5-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-dimethyl-5-[(3-methyl-4-phenyl-1h-pyrazol-5-ylamino)methylidene]hexahydropyrimidine-2,4,6-trione, 1,3-dimethyl-5-[[(5-methyl-4-phenyl-1H-pyrazol-3-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C17H17N5O3 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.13315 |
| Heavy Atoms | 25 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 890641-93-7 |
|---|---|
| SMILES | CC1=C(C(=NN1)N=CC2=C(N(C(=O)N(C2=O)C)C)O)C3=CC=CC=C3 |
| InChIKey | MSYJOXULXCMNTM-UHFFFAOYSA-N |
Product Overview
BAS 11216129 (CAS 890641-93-7), with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol. IUPAC: 6-hydroxy-1,3-dimethyl-5-[(5-methyl-4-phenyl-1H-pyrazol-3-yl)iminomethyl]pyrimidine-2,4-dione.
Chemical Property Profile of BAS 11216129
Property Insights of BAS 11216129
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 11216129. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11216129. Following Lipinski's Rule of Five, BAS 11216129 has 2 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 11216129?
The CAS number of BAS 11216129 is 890641-93-7.
What is the molecular formula of BAS 11216129?
The molecular formula of BAS 11216129 is C17H17N5O3.
What is the molecular weight of BAS 11216129?
The molecular weight of BAS 11216129 is 339.13 g/mol.
Where can I buy BAS 11216129?
You can request a quote for BAS 11216129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11216129?
Yes, KEHONG BIO provides custom synthesis services for BAS 11216129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.