![[(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea structure](/static/products/5082/50823-54-6.webp)
[(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
TL;DR: [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea (CAS 50823-54-6) is a chemical compound with molecular formula C15H21N3O3S and molecular weight 323.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
Also Known As: 6-Thiosemicarbazono-2,3,4-trimethoxybenzocycloheptane, 2-(5,7,8,9-Tetrahydro-2,3,4-trimethoxy-6H-benzocyclohepten-6-ylidene)hydrazinecarbothioamide, Hydrazinecarbothioamide, 2-(5,7,8,9-tetrahydro-2,3,4-trimethoxy-6H-benzocyclohepten-6-ylidene)-
| Molecular Formula | C15H21N3O3S |
|---|---|
| Molecular Weight | 323.13 g/mol |
| LogP | 1.7804 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.13037 |
| Heavy Atoms | 22 |
| Complexity | 602.1857 |
Chemical Identifiers
| CAS Number | 50823-54-6 |
|---|---|
| SMILES | COC1=C(C(=C2CC(=NNC(=S)N)CCCC2=C1)OC)OC |
Product Overview
[(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea (CAS 50823-54-6), with molecular formula C15H21N3O3S and molecular weight 323.13 g/mol. IUPAC: [(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea.
Chemical Property Profile of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
Property Insights of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
The XLogP value of 1.7804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea. Following Lipinski's Rule of Five, [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea has 2 hydrogen bond donor(s) and 5 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 [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea?
The CAS number of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea is 50823-54-6.
What is the molecular formula of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea?
The molecular formula of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea is C15H21N3O3S.
What is the molecular weight of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea?
The molecular weight of [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea is 323.13 g/mol.
Where can I buy [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea?
You can request a quote for [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(2,3,4-Trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.