![1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea structure](/static/products/3240/32403-51-3.webp)
1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea
TL;DR: 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea (CAS 32403-51-3) is a chemical compound with molecular formula C19H22N4O4S and molecular weight 402.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea
Also Known As: 1-(1-adamantyl)-3-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyli, 1-(1-adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea
| Molecular Formula | C19H22N4O4S |
|---|---|
| Molecular Weight | 402.14 g/mol |
| LogP | 3.0903 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.13617 |
| Heavy Atoms | 28 |
| Complexity | 836.45056 |
Chemical Identifiers
| CAS Number | 32403-51-3 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=S)NN=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5 |
Product Overview
1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea (CAS 32403-51-3), with molecular formula C19H22N4O4S and molecular weight 402.14 g/mol. IUPAC: 1-(1-adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea.
Chemical Property Profile of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea
Property Insights of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea
The XLogP value of 3.0903 indicates that 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea has 2 hydrogen bond donor(s) and 6 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-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea?
The CAS number of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea is 32403-51-3.
What is the molecular formula of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea?
The molecular formula of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea is C19H22N4O4S.
What is the molecular weight of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea?
The molecular weight of 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea is 402.14 g/mol.
Where can I buy 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea?
You can request a quote for 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)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-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.