![(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea structure](/static/products/1010/101077-17-2.webp)
(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea
TL;DR: (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea (CAS 101077-17-2) is a chemical compound with molecular formula C14H18N4S and molecular weight 274.13 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-7-ylmethylideneamino)thiourea
Also Known As: 9-Julolidine carboxaldehyde thiosemicarbazone
| Molecular Formula | C14H18N4S |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 1.5525 |
| Topological Polar Surface Area | 53.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.1252 |
| Heavy Atoms | 19 |
| Complexity | 507.24265 |
Chemical Identifiers
| CAS Number | 101077-17-2 |
|---|---|
| SMILES | C1CC2=CC(=CC3=C2N(C1)CCC3)C=NNC(=S)N |
Product Overview
(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea (CAS 101077-17-2), with molecular formula C14H18N4S and molecular weight 274.13 g/mol. IUPAC: (1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea.
Chemical Property Profile of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea
Property Insights of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea
The XLogP value of 1.5525 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea. With a topological polar surface area (TPSA) of 53.65 Ų, (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea 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-7-ylmethylideneamino)thiourea?
The CAS number of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea is 101077-17-2.
What is the molecular formula of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea?
The molecular formula of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea is C14H18N4S.
What is the molecular weight of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea?
The molecular weight of (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea is 274.13 g/mol.
Where can I buy (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea?
You can request a quote for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-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-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylideneamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.