BAS 01846012
TL;DR: BAS 01846012 (CAS 6099-98-5) is a chemical compound with molecular formula C21H23ClN4OS and molecular weight 414.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methylphenyl)-4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 01846012, BIM-0002272.P001, N-(5-CHLORO-2-METHYLPHENYL)-4-[4-(DIMETHYLAMINO)PHENYL]-6-METHYL-2-SULFANYLIDENE-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXAMIDE, {6-[4-(dimethylamino)phenyl]-4-methyl-2-thioxo(1,3,6-trihydropyrimidin-5-yl)}- N-(5-chloro-2-methylphenyl)carboxamide, N-(5-chloro-2-methylphenyl)-4-(4-dimethylaminophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
| Molecular Formula | C21H23ClN4OS |
|---|---|
| Molecular Weight | 414.13 g/mol |
| LogP | 4.14592 |
| Topological Polar Surface Area | 56.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.1281 |
| Heavy Atoms | 28 |
| Complexity | 953.378 |
Chemical Identifiers
| CAS Number | 6099-98-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(NC(=S)NC2C3=CC=C(C=C3)N(C)C)C |
Product Overview
BAS 01846012 (CAS 6099-98-5), with molecular formula C21H23ClN4OS and molecular weight 414.13 g/mol. IUPAC: N-(5-chloro-2-methylphenyl)-4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 01846012
Property Insights of BAS 01846012
The XLogP value of 4.14592 indicates that BAS 01846012 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.4 Ų, BAS 01846012 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01846012 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 01846012?
The CAS number of BAS 01846012 is 6099-98-5.
What is the molecular formula of BAS 01846012?
The molecular formula of BAS 01846012 is C21H23ClN4OS.
What is the molecular weight of BAS 01846012?
The molecular weight of BAS 01846012 is 414.13 g/mol.
Where can I buy BAS 01846012?
You can request a quote for BAS 01846012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01846012?
Yes, KEHONG BIO provides custom synthesis services for BAS 01846012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.