BAS 01555716
TL;DR: BAS 01555716 (CAS 332389-95-4) is a chemical compound with molecular formula C18H18IN3O2S2 and molecular weight 498.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-iodobenzoyl)carbamothioylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BAS 01555716, 2-[(2-iodobenzoyl)carbamothioylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-({[(2-iodobenzoyl)amino]carbothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-(3-(2-iodobenzoyl)thioureido)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-({[(2-iodophenyl)carbonyl]carbamothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C18H18IN3O2S2 |
|---|---|
| Molecular Weight | 498.99 g/mol |
| LogP | 3.7032 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 498.98853 |
| Heavy Atoms | 26 |
| Complexity | 894.5565 |
Chemical Identifiers
| CAS Number | 332389-95-4 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=S)NC(=O)C3=CC=CC=C3I |
Product Overview
BAS 01555716 (CAS 332389-95-4), with molecular formula C18H18IN3O2S2 and molecular weight 498.99 g/mol. IUPAC: 2-[(2-iodobenzoyl)carbamothioylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BAS 01555716
Property Insights of BAS 01555716
The XLogP value of 3.7032 indicates that BAS 01555716 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 01555716. Following Lipinski's Rule of Five, BAS 01555716 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 01555716?
The CAS number of BAS 01555716 is 332389-95-4.
What is the molecular formula of BAS 01555716?
The molecular formula of BAS 01555716 is C18H18IN3O2S2.
What is the molecular weight of BAS 01555716?
The molecular weight of BAS 01555716 is 498.99 g/mol.
Where can I buy BAS 01555716?
You can request a quote for BAS 01555716 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01555716?
Yes, KEHONG BIO provides custom synthesis services for BAS 01555716 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.