![(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea structure](/static/products/1010/101077-38-7.webp)
(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea
TL;DR: (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea (CAS 101077-38-7) is a chemical compound with molecular formula C13H16N4O and molecular weight 244.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea
Also Known As: 1-Ketojulolidine semicarbazone, 2-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-1-ylidene)hydrazinecarboxamide
| Molecular Formula | C13H16N4O |
|---|---|
| Molecular Weight | 244.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.13242 |
| Heavy Atoms | 18 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 101077-38-7 |
|---|---|
| SMILES | C1CC2=C3C(=CC=C2)C(=NNC(=O)N)CCN3C1 |
| InChIKey | UVGFNXHHNWNTKR-UHFFFAOYSA-N |
Product Overview
(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea (CAS 101077-38-7), with molecular formula C13H16N4O and molecular weight 244.13 g/mol. IUPAC: (1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea.
Chemical Property Profile of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea
Property Insights of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea. Following Lipinski's Rule of Five, (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea has 2 hydrogen bond donor(s) and 3 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-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea?
The CAS number of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea is 101077-38-7.
What is the molecular formula of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea?
The molecular formula of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea is C13H16N4O.
What is the molecular weight of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea?
The molecular weight of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea is 244.13 g/mol.
Where can I buy (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea?
You can request a quote for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea?
Yes, KEHONG BIO provides custom synthesis services for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylideneamino)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.