AB00673063-01
TL;DR: AB00673063-01 (CAS 440091-39-4) is a chemical compound with molecular formula C23H27N3O3S and molecular weight 425.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethoxyphenyl)-6-methyl-4-(4-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: AB00673063-01, N-(2,5-dimethoxyphenyl)-6-methyl-4-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide, F1043-0412, N-(2,5-dimethoxyphenyl)-4-(4-isopropylphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(2,5-dimethoxyphenyl)-6-methyl-4-(4-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
| Molecular Formula | C23H27N3O3S |
|---|---|
| Molecular Weight | 425.18 g/mol |
| LogP | 4.2587 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 425.1773 |
| Heavy Atoms | 30 |
| Complexity | 983.68787 |
Chemical Identifiers
| CAS Number | 440091-39-4 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)C(C)C)C(=O)NC3=C(C=CC(=C3)OC)OC |
Product Overview
AB00673063-01 (CAS 440091-39-4), with molecular formula C23H27N3O3S and molecular weight 425.18 g/mol. IUPAC: N-(2,5-dimethoxyphenyl)-6-methyl-4-(4-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00673063-01
Property Insights of AB00673063-01
The XLogP value of 4.2587 indicates that AB00673063-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673063-01. Following Lipinski's Rule of Five, AB00673063-01 has 3 hydrogen bond donor(s) and 4 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 AB00673063-01?
The CAS number of AB00673063-01 is 440091-39-4.
What is the molecular formula of AB00673063-01?
The molecular formula of AB00673063-01 is C23H27N3O3S.
What is the molecular weight of AB00673063-01?
The molecular weight of AB00673063-01 is 425.18 g/mol.
Where can I buy AB00673063-01?
You can request a quote for AB00673063-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673063-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673063-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.