4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone
TL;DR: 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone (CAS 6292-78-0) is a chemical compound with molecular formula C12H17N3O2S and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-methoxy-4-propan-2-yloxyphenyl)methylideneamino]thiourea
Also Known As: 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone, [(3-methoxy-4-propan-2-yloxyphenyl)methylideneamino]thiourea
| Molecular Formula | C12H17N3O2S |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 1.6495 |
| Topological Polar Surface Area | 68.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.10416 |
| Heavy Atoms | 18 |
| Complexity | 446.9487 |
Chemical Identifiers
| CAS Number | 6292-78-0 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C=C1)C=NNC(=S)N)OC |
Product Overview
4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone (CAS 6292-78-0), with molecular formula C12H17N3O2S and molecular weight 267.10 g/mol. IUPAC: [(3-methoxy-4-propan-2-yloxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone
Property Insights of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone
The XLogP value of 1.6495 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone. The TPSA of 68.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone. Following Lipinski's Rule of Five, 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone has 2 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 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone?
The CAS number of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone is 6292-78-0.
What is the molecular formula of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone?
The molecular formula of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone is C12H17N3O2S.
What is the molecular weight of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone?
The molecular weight of 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone is 267.10 g/mol.
Where can I buy 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone?
You can request a quote for 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 4-isopropoxy-3-methoxybenzaldehyde thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.