![1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea structure](/static/products/4382/438233-52-4.webp)
1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea
TL;DR: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea (CAS 438233-52-4) is a chemical compound with molecular formula C14H19N3OS2 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea
Also Known As: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea, N-allyl-2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)carbonyl]hydrazinecarbothioamide, 2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide, (6-methyl(4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl))-N-{[(prop-2-enylamino)thio xomethyl]amino}carboxamide
| Molecular Formula | C14H19N3OS2 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 2.1678 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.09695 |
| Heavy Atoms | 20 |
| Complexity | 524.4887 |
Chemical Identifiers
| CAS Number | 438233-52-4 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC=C2C(=O)NNC(=S)NCC=C |
Product Overview
1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea (CAS 438233-52-4), with molecular formula C14H19N3OS2 and molecular weight 309.10 g/mol. IUPAC: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea.
Chemical Property Profile of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea
Property Insights of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea
The XLogP value of 2.1678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea. With a topological polar surface area (TPSA) of 53.16 Ų, 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea has 3 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-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea?
The CAS number of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea is 438233-52-4.
What is the molecular formula of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea?
The molecular formula of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea is C14H19N3OS2.
What is the molecular weight of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea?
The molecular weight of 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea is 309.10 g/mol.
Where can I buy 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea?
You can request a quote for 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.