![1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea structure](/static/products/324/32403-41-1.png)
1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea
TL;DR: 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea (CAS 32403-41-1) is a chemical compound with molecular formula C22H31N3O2S and molecular weight 401.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea
Also Known As: 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea, (2E)-N-(Adamantan-1-yl)-2-[(3,4-diethoxyphenyl)methylidene]hydrazine-1-carbothioamide
| Molecular Formula | C22H31N3O2S |
|---|---|
| Molecular Weight | 401.21 g/mol |
| LogP | 4.2508 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 401.21368 |
| Heavy Atoms | 28 |
| Complexity | 714.01324 |
Chemical Identifiers
| CAS Number | 32403-41-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=N/NC(=S)NC23CC4CC(C2)CC(C4)C3)OCC |
Product Overview
1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea (CAS 32403-41-1), with molecular formula C22H31N3O2S and molecular weight 401.21 g/mol. IUPAC: 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea
Property Insights of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea
The XLogP value of 4.2508 indicates that 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea 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 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea?
The CAS number of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea is 32403-41-1.
What is the molecular formula of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea?
The molecular formula of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea is C22H31N3O2S.
What is the molecular weight of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea?
The molecular weight of 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea is 401.21 g/mol.
Where can I buy 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea?
You can request a quote for 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-adamantyl)-3-[(E)-(3,4-diethoxyphenyl)methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.