BAS 00444381
TL;DR: BAS 00444381 (CAS 296266-44-9) is a chemical compound with molecular formula C12H14N4O2S and molecular weight 278.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[ethyl-[(E)-thiophen-2-ylmethylideneamino]amino]-3-methyl-1H-pyrimidine-2,4-dione
Also Known As: BAS 00444381, 6-[(2E)-1-ethyl-2-(thiophen-2-ylmethylidene)hydrazinyl]-3-methylpyrimidine-2,4(1H,3H)-dione, (E)-6-(1-ethyl-2-(thiophen-2-ylmethylene)hydrazinyl)-3-methylpyrimidine-2,4(1H,3H)-dione, 6-(N-Ethyl-N'-thiophen-2-ylmethylene-hydrazino)-3-methyl-1H-pyrimidine-2,4-dione, 6-[((1E)-2-(2-thienyl)-1-azavinyl)ethylamino]-3-methyl-1,3-dihydropyrimidine-2 ,4-dione
| Molecular Formula | C12H14N4O2S |
|---|---|
| Molecular Weight | 278.08 g/mol |
| LogP | 0.9955 |
| Topological Polar Surface Area | 70.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.08374 |
| Heavy Atoms | 19 |
| Complexity | 653.24524 |
Chemical Identifiers
| CAS Number | 296266-44-9 |
|---|---|
| SMILES | CCN(C1=CC(=O)N(C(=O)N1)C)/N=C/C2=CC=CS2 |
Product Overview
BAS 00444381 (CAS 296266-44-9), with molecular formula C12H14N4O2S and molecular weight 278.08 g/mol. IUPAC: 6-[ethyl-[(E)-thiophen-2-ylmethylideneamino]amino]-3-methyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of BAS 00444381
Property Insights of BAS 00444381
The XLogP value of 0.9955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00444381. The TPSA of 70.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00444381. Following Lipinski's Rule of Five, BAS 00444381 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 00444381?
The CAS number of BAS 00444381 is 296266-44-9.
What is the molecular formula of BAS 00444381?
The molecular formula of BAS 00444381 is C12H14N4O2S.
What is the molecular weight of BAS 00444381?
The molecular weight of BAS 00444381 is 278.08 g/mol.
Where can I buy BAS 00444381?
You can request a quote for BAS 00444381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00444381?
Yes, KEHONG BIO provides custom synthesis services for BAS 00444381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.