![1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea structure](/static/products/324/32403-50-2.png)
1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea
TL;DR: 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea (CAS 32403-50-2) is a chemical compound with molecular formula C19H23N3O2S and molecular weight 357.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea
Also Known As: 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea, (2E)-N-(Adamantan-1-yl)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carbothioamide
| Molecular Formula | C19H23N3O2S |
|---|---|
| Molecular Weight | 357.15 g/mol |
| LogP | 3.1821 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.1511 |
| Heavy Atoms | 25 |
| Complexity | 698.0952 |
Chemical Identifiers
| CAS Number | 32403-50-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=S)N/N=C/C4=CC5=C(C=C4)OCO5 |
Product Overview
1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea (CAS 32403-50-2), with molecular formula C19H23N3O2S and molecular weight 357.15 g/mol. IUPAC: 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea.
Chemical Property Profile of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea
Property Insights of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea
The XLogP value of 3.1821 indicates that 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]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)-1,3-benzodioxol-5-ylmethylideneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]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)-1,3-benzodioxol-5-ylmethylideneamino]thiourea?
The CAS number of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea is 32403-50-2.
What is the molecular formula of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea?
The molecular formula of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea is C19H23N3O2S.
What is the molecular weight of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea?
The molecular weight of 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea is 357.15 g/mol.
Where can I buy 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea?
You can request a quote for 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]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)-1,3-benzodioxol-5-ylmethylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-adamantyl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.