![4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE structure](/static/products/3030/303010-08-4.webp)
4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE
TL;DR: 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE (CAS 303010-08-4) is a chemical compound with molecular formula C27H20N4O3S2 and molecular weight 512.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(naphthalen-1-ylmethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitrobenzaldehyde
Also Known As: 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE, 4-[(5-([ THIO]-3-NITROBENZALDEHYDE, 4-[[5-(naphthalen-1-ylmethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitrobenzaldehyde, 4-((5-(((Naphthalen-1-ylmethyl)thio)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-3-nitrobenzaldehyde, 4-{[5-({[(Naphthalen-1-yl)methyl]sulfanyl}methyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrobenzaldehyde
| Molecular Formula | C27H20N4O3S2 |
|---|---|
| Molecular Weight | 512.10 g/mol |
| LogP | 6.7258 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 512.09766 |
| Heavy Atoms | 36 |
| Complexity | 1548.5197 |
Chemical Identifiers
| CAS Number | 303010-08-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=C(C=C3)C=O)[N+](=O)[O-])CSCC4=CC=CC5=CC=CC=C54 |
Product Overview
4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE (CAS 303010-08-4), with molecular formula C27H20N4O3S2 and molecular weight 512.10 g/mol. IUPAC: 4-[[5-(naphthalen-1-ylmethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitrobenzaldehyde.
Chemical Property Profile of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE
Property Insights of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE
The XLogP value of 6.7258 indicates that 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE. Following Lipinski's Rule of Five, 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE?
The CAS number of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE is 303010-08-4.
What is the molecular formula of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE?
The molecular formula of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE is C27H20N4O3S2.
What is the molecular weight of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE?
The molecular weight of 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE is 512.10 g/mol.
Where can I buy 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE?
You can request a quote for 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE?
Yes, KEHONG BIO provides custom synthesis services for 4-[(5-([(1-NAPHTHYLMETHYL)THIO]METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-3-NITROBENZALDEHYDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.