ChemDiv3_001104
TL;DR: ChemDiv3_001104 (CAS 301675-80-9) is a chemical compound with molecular formula C21H25N3OS and molecular weight 367.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-methoxyphenyl)-2-phenylimino-1,3-thiazol-3-yl]-N,N-dimethylpropan-1-amine
Also Known As: ChemDiv3_001104, Probes1_000122, Probes2_000123, IDI1_020070, NCI60_036476
| Molecular Formula | C21H25N3OS |
|---|---|
| Molecular Weight | 367.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 53.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.17184 |
| Heavy Atoms | 26 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 301675-80-9 |
|---|---|
| SMILES | CN(C)CCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)OC |
| InChIKey | POVGDMXEDGPTGA-UHFFFAOYSA-N |
Product Overview
ChemDiv3_001104 (CAS 301675-80-9), with molecular formula C21H25N3OS and molecular weight 367.17 g/mol. IUPAC: 3-[4-(4-methoxyphenyl)-2-phenylimino-1,3-thiazol-3-yl]-N,N-dimethylpropan-1-amine.
Chemical Property Profile of ChemDiv3_001104
Property Insights of ChemDiv3_001104
The XLogP value of 4.3 indicates that ChemDiv3_001104 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.4 Ų, ChemDiv3_001104 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_001104 has 0 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 ChemDiv3_001104?
The CAS number of ChemDiv3_001104 is 301675-80-9.
What is the molecular formula of ChemDiv3_001104?
The molecular formula of ChemDiv3_001104 is C21H25N3OS.
What is the molecular weight of ChemDiv3_001104?
The molecular weight of ChemDiv3_001104 is 367.17 g/mol.
Where can I buy ChemDiv3_001104?
You can request a quote for ChemDiv3_001104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_001104?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_001104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.