AB00115975-01
TL;DR: AB00115975-01 (CAS 431895-83-9) is a chemical compound with molecular formula C22H26N4O3S and molecular weight 426.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethoxyphenyl)-4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: AB00115975-01, N-(2,4-dimethoxyphenyl)-4-(4-(dimethylamino)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(2,4-dimethoxyphenyl)-4-(4-dimethylaminophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(2,4-DIMETHOXYPHENYL)-4-[4-(DIMETHYLAMINO)PHENYL]-6-METHYL-2-SULFANYLIDENE-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXAMIDE, N-(2,4-DIMETHOXYPHENYL)-4-[4-(DIMETHYLAMINO)PHENYL]-6-METHYL-2-SULFANYLIDENE-3,4-DIHYDRO-1H-PYRIMIDINE-5-CARBOXAMIDE
| Molecular Formula | C22H26N4O3S |
|---|---|
| Molecular Weight | 426.17 g/mol |
| LogP | 3.2013 |
| Topological Polar Surface Area | 74.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.17258 |
| Heavy Atoms | 30 |
| Complexity | 986.3772 |
Chemical Identifiers
| CAS Number | 431895-83-9 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)N(C)C)C(=O)NC3=C(C=C(C=C3)OC)OC |
Product Overview
AB00115975-01 (CAS 431895-83-9), with molecular formula C22H26N4O3S and molecular weight 426.17 g/mol. IUPAC: N-(2,4-dimethoxyphenyl)-4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00115975-01
Property Insights of AB00115975-01
The XLogP value of 3.2013 indicates that AB00115975-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00115975-01. Following Lipinski's Rule of Five, AB00115975-01 has 3 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 AB00115975-01?
The CAS number of AB00115975-01 is 431895-83-9.
What is the molecular formula of AB00115975-01?
The molecular formula of AB00115975-01 is C22H26N4O3S.
What is the molecular weight of AB00115975-01?
The molecular weight of AB00115975-01 is 426.17 g/mol.
Where can I buy AB00115975-01?
You can request a quote for AB00115975-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115975-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115975-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.