1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea
TL;DR: 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea (CAS 1005151-20-1) is a chemical compound with molecular formula C18H21N5O2S and molecular weight 371.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea
Also Known As: A3573/0151620, 1-(3-bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea, N-(bicyclo[2.2.1]hept-2-yl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazinecarbothioamide, N-((1S,4R)-bicyclo[2.2.1]heptan-2-yl)-2-(2-(1-oxophthalazin-2(1H)-yl)acetyl)hydrazinecarbothioamide
| Molecular Formula | C18H21N5O2S |
|---|---|
| Molecular Weight | 371.14 g/mol |
| LogP | 1.0804 |
| Topological Polar Surface Area | 88.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.1416 |
| Heavy Atoms | 26 |
| Complexity | 911.8348 |
Chemical Identifiers
| CAS Number | 1005151-20-1 |
|---|---|
| SMILES | C1CC2CC1CC2NC(=S)NNC(=O)CN3C(=O)C4=CC=CC=C4C=N3 |
Product Overview
1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea (CAS 1005151-20-1), with molecular formula C18H21N5O2S and molecular weight 371.14 g/mol. IUPAC: 1-(2-bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea.
Chemical Property Profile of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea
Property Insights of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea
The XLogP value of 1.0804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea. The TPSA of 88.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea. Following Lipinski's Rule of Five, 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea has 3 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-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea?
The CAS number of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea is 1005151-20-1.
What is the molecular formula of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea?
The molecular formula of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea is C18H21N5O2S.
What is the molecular weight of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea?
The molecular weight of 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea is 371.14 g/mol.
Where can I buy 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea?
You can request a quote for 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bicyclo[2.2.1]heptanyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.