CAS 402945-81-7 - C17H16N4O3S
TL;DR: CAS 402945-81-7 - C17H16N4O3S (CAS 402945-81-7) is a chemical compound with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-ylmethyl)-4-methyl-N-[(E)-1-(3-nitrophenyl)ethylideneamino]-1,3-thiazol-2-imine
Also Known As: (2Z)-3-[(furan-2-yl)methyl]-4-methyl-2-[(E)-2-[1-(3-nitrophenyl)ethylidene]hydrazin-1-ylidene]-2,3-dihydro-1,3-thiazole
| Molecular Formula | C17H16N4O3S |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 3.73242 |
| Topological Polar Surface Area | 85.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.0943 |
| Heavy Atoms | 25 |
| Complexity | 983.4991 |
Chemical Identifiers
| CAS Number | 402945-81-7 |
|---|---|
| SMILES | CC1=CS/C(=N/N=C(\C)/C2=CC(=CC=C2)[N+](=O)[O-])/N1CC3=CC=CO3 |
Product Overview
CAS 402945-81-7 - C17H16N4O3S (CAS 402945-81-7), with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol. IUPAC: (E)-3-(furan-2-ylmethyl)-4-methyl-N-[(E)-1-(3-nitrophenyl)ethylideneamino]-1,3-thiazol-2-imine.
Chemical Property Profile of CAS 402945-81-7 - C17H16N4O3S
Property Insights of CAS 402945-81-7 - C17H16N4O3S
The XLogP value of 3.73242 indicates that CAS 402945-81-7 - C17H16N4O3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.93 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 402945-81-7 - C17H16N4O3S. Following Lipinski's Rule of Five, CAS 402945-81-7 - C17H16N4O3S has 0 hydrogen bond donor(s) and 6 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 CAS 402945-81-7 - C17H16N4O3S?
The CAS number of CAS 402945-81-7 - C17H16N4O3S is 402945-81-7.
What is the molecular formula of CAS 402945-81-7 - C17H16N4O3S?
The molecular formula of CAS 402945-81-7 - C17H16N4O3S is C17H16N4O3S.
What is the molecular weight of CAS 402945-81-7 - C17H16N4O3S?
The molecular weight of CAS 402945-81-7 - C17H16N4O3S is 356.09 g/mol.
Where can I buy CAS 402945-81-7 - C17H16N4O3S?
You can request a quote for CAS 402945-81-7 - C17H16N4O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 402945-81-7 - C17H16N4O3S?
Yes, KEHONG BIO provides custom synthesis services for CAS 402945-81-7 - C17H16N4O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.