MixCom6_000905
TL;DR: MixCom6_000905 (CAS 331676-00-7) is a chemical compound with molecular formula C19H19N3O2S and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxyphenyl)-6-methyl-N-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: MixCom6_000905, DivK1c_005337, CDS1_004297, BAS 00458566, BIM-0023733.P001
| Molecular Formula | C19H19N3O2S |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | 3.13212 |
| Topological Polar Surface Area | 73.39 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.1198 |
| Heavy Atoms | 25 |
| Complexity | 841.97784 |
Chemical Identifiers
| CAS Number | 331676-00-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2=C(NC(=S)NC2C3=CC=C(C=C3)O)C |
Product Overview
MixCom6_000905 (CAS 331676-00-7), with molecular formula C19H19N3O2S and molecular weight 353.12 g/mol. IUPAC: 4-(4-hydroxyphenyl)-6-methyl-N-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of MixCom6_000905
Property Insights of MixCom6_000905
The XLogP value of 3.13212 indicates that MixCom6_000905 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.39 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_000905. Following Lipinski's Rule of Five, MixCom6_000905 has 4 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 MixCom6_000905?
The CAS number of MixCom6_000905 is 331676-00-7.
What is the molecular formula of MixCom6_000905?
The molecular formula of MixCom6_000905 is C19H19N3O2S.
What is the molecular weight of MixCom6_000905?
The molecular weight of MixCom6_000905 is 353.12 g/mol.
Where can I buy MixCom6_000905?
You can request a quote for MixCom6_000905 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_000905?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_000905 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.