BENZALDEHYDE,3-ETHOXY-5-METHOXY
TL;DR: BENZALDEHYDE,3-ETHOXY-5-METHOXY (CAS 681458-85-5) is a chemical compound with molecular formula C14H18N4OS and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-6-propan-2-yl-5,7-dihydro-[1,2,4]triazolo[3,4-b][1,3,5]thiadiazine
Also Known As: BENZALDEHYDE,3-ETHOXY-5-METHOXY, 3-(2-methoxyphenyl)-6-propan-2-yl-5,7-dihydro-[1,2,4]triazolo[3,4-b][1,3,5]thiadiazine, 6-isopropyl-3-(2-methoxyphenyl)-6,7-dihydro-5H-[1,2,4]triazo, 9-(2-methoxyphenyl)-3-propan-2-yl-5-thia-1,3,7,8-tetrazabicyclo[4.3.0]nona-6,8-diene, 6-isopropyl-3-(2-methoxyphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,5]thiadiazine (en)5H-1,2,4-Triazolo[3,4-b][1,3,5]thiadiazine, 6,7-dihydro-3-(2-methoxyphenyl)-6-(1-methylethyl)- (en)
| Molecular Formula | C14H18N4OS |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 2.6848 |
| Topological Polar Surface Area | 43.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.12012 |
| Heavy Atoms | 20 |
| Complexity | 610.97144 |
Chemical Identifiers
| CAS Number | 681458-85-5 |
|---|---|
| SMILES | CC(C)N1CN2C(=NN=C2SC1)C3=CC=CC=C3OC |
Product Overview
BENZALDEHYDE,3-ETHOXY-5-METHOXY (CAS 681458-85-5), with molecular formula C14H18N4OS and molecular weight 290.12 g/mol. IUPAC: 3-(2-methoxyphenyl)-6-propan-2-yl-5,7-dihydro-[1,2,4]triazolo[3,4-b][1,3,5]thiadiazine.
Chemical Property Profile of BENZALDEHYDE,3-ETHOXY-5-METHOXY
Property Insights of BENZALDEHYDE,3-ETHOXY-5-METHOXY
The XLogP value of 2.6848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BENZALDEHYDE,3-ETHOXY-5-METHOXY. With a topological polar surface area (TPSA) of 43.18 Ų, BENZALDEHYDE,3-ETHOXY-5-METHOXY exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BENZALDEHYDE,3-ETHOXY-5-METHOXY has 0 hydrogen bond donor(s) and 5 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 BENZALDEHYDE,3-ETHOXY-5-METHOXY?
The CAS number of BENZALDEHYDE,3-ETHOXY-5-METHOXY is 681458-85-5.
What is the molecular formula of BENZALDEHYDE,3-ETHOXY-5-METHOXY?
The molecular formula of BENZALDEHYDE,3-ETHOXY-5-METHOXY is C14H18N4OS.
What is the molecular weight of BENZALDEHYDE,3-ETHOXY-5-METHOXY?
The molecular weight of BENZALDEHYDE,3-ETHOXY-5-METHOXY is 290.12 g/mol.
Where can I buy BENZALDEHYDE,3-ETHOXY-5-METHOXY?
You can request a quote for BENZALDEHYDE,3-ETHOXY-5-METHOXY directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BENZALDEHYDE,3-ETHOXY-5-METHOXY?
Yes, KEHONG BIO provides custom synthesis services for BENZALDEHYDE,3-ETHOXY-5-METHOXY and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.