BAS 01067084
TL;DR: BAS 01067084 (CAS 334503-56-9) is a chemical compound with molecular formula C18H19N3O2S2 and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzoylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BAS 01067084, 2-(3-benzoylthioureido)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-(benzoylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 6-methyl-2-{[(phenylcarbonyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 6-methyl-2-{[(phenylcarbonylamino)thioxomethyl]amino}-4,5,6,7-tetrahydrobenzo[ b]thiophene-3-carboxamide
| Molecular Formula | C18H19N3O2S2 |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | 3.0986 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.09186 |
| Heavy Atoms | 25 |
| Complexity | 830.34674 |
Chemical Identifiers
| CAS Number | 334503-56-9 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=S)NC(=O)C3=CC=CC=C3 |
Product Overview
BAS 01067084 (CAS 334503-56-9), with molecular formula C18H19N3O2S2 and molecular weight 373.09 g/mol. IUPAC: 2-(benzoylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BAS 01067084
Property Insights of BAS 01067084
The XLogP value of 3.0986 indicates that BAS 01067084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01067084. Following Lipinski's Rule of Five, BAS 01067084 has 3 hydrogen bond donor(s) and 4 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 BAS 01067084?
The CAS number of BAS 01067084 is 334503-56-9.
What is the molecular formula of BAS 01067084?
The molecular formula of BAS 01067084 is C18H19N3O2S2.
What is the molecular weight of BAS 01067084?
The molecular weight of BAS 01067084 is 373.09 g/mol.
Where can I buy BAS 01067084?
You can request a quote for BAS 01067084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01067084?
Yes, KEHONG BIO provides custom synthesis services for BAS 01067084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.