![(6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea structure](/static/products/598/59801-07-9.png)
(6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea
TL;DR: (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea (CAS 59801-07-9) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylideneamino)urea
Also Known As: NCI60_021399, 6,7,8,9-tetrahydro-benzocyclohepten-5-one semicarbazone, (6,7,8,9-tetrahydrobenzo[7]annulen-5-ylideneamino)urea, 2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylidene)hydrazinecarboxamide
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 59801-07-9 |
|---|---|
| SMILES | C1CCC(=NNC(=O)N)C2=CC=CC=C2C1 |
| InChIKey | ZGVPGUWXAWGLFP-UHFFFAOYSA-N |
Product Overview
(6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea (CAS 59801-07-9), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: (6,7,8,9-tetrahydrobenzo[7]annulen-5-ylideneamino)urea.
Chemical Property Profile of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea
Property Insights of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea. Following Lipinski's Rule of Five, (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea has 2 hydrogen bond donor(s) and 2 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 (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea?
The CAS number of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea is 59801-07-9.
What is the molecular formula of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea?
The molecular formula of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea is C12H15N3O.
What is the molecular weight of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea?
The molecular weight of (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea is 217.12 g/mol.
Where can I buy (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea?
You can request a quote for (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea?
Yes, KEHONG BIO provides custom synthesis services for (6,7,8,9-Tetrahydrobenzo[7]annulen-5-ylideneamino)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.