BAS 01836676
TL;DR: BAS 01836676 (CAS 332849-72-6) is a chemical compound with molecular formula C16H15N3O2S and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(furan-2-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 01836676, 4-(furan-2-yl)-6-methyl-N-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 4-(2-furyl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide, 4-(furan-2-yl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 4-(furan-2-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
| Molecular Formula | C16H15N3O2S |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 2.7111 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.0885 |
| Heavy Atoms | 22 |
| Complexity | 723.1139 |
Chemical Identifiers
| CAS Number | 332849-72-6 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=CO2)C(=O)NC3=CC=CC=C3 |
Product Overview
BAS 01836676 (CAS 332849-72-6), with molecular formula C16H15N3O2S and molecular weight 313.09 g/mol. IUPAC: 4-(furan-2-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 01836676
Property Insights of BAS 01836676
The XLogP value of 2.7111 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01836676. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01836676. Following Lipinski's Rule of Five, BAS 01836676 has 3 hydrogen bond donor(s) and 3 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 01836676?
The CAS number of BAS 01836676 is 332849-72-6.
What is the molecular formula of BAS 01836676?
The molecular formula of BAS 01836676 is C16H15N3O2S.
What is the molecular weight of BAS 01836676?
The molecular weight of BAS 01836676 is 313.09 g/mol.
Where can I buy BAS 01836676?
You can request a quote for BAS 01836676 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01836676?
Yes, KEHONG BIO provides custom synthesis services for BAS 01836676 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.