BAS 01555697
TL;DR: BAS 01555697 (CAS 370575-50-1) is a chemical compound with molecular formula C22H18Cl2N4O2S2 and molecular weight 504.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: BAS 01555697, N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide, N-((3-cyano-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamothioyl)-3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxamide
| Molecular Formula | C22H18Cl2N4O2S2 |
|---|---|
| Molecular Weight | 504.02 g/mol |
| LogP | 6.1416 |
| Topological Polar Surface Area | 90.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 504.0248 |
| Heavy Atoms | 32 |
| Complexity | 1255.44 |
Chemical Identifiers
| CAS Number | 370575-50-1 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(ON=C3C4=C(C=CC=C4Cl)Cl)C |
Product Overview
BAS 01555697 (CAS 370575-50-1), with molecular formula C22H18Cl2N4O2S2 and molecular weight 504.02 g/mol. IUPAC: N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of BAS 01555697
Property Insights of BAS 01555697
The XLogP value of 6.1416 indicates that BAS 01555697 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01555697. Following Lipinski's Rule of Five, BAS 01555697 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01555697?
The CAS number of BAS 01555697 is 370575-50-1.
What is the molecular formula of BAS 01555697?
The molecular formula of BAS 01555697 is C22H18Cl2N4O2S2.
What is the molecular weight of BAS 01555697?
The molecular weight of BAS 01555697 is 504.02 g/mol.
Where can I buy BAS 01555697?
You can request a quote for BAS 01555697 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01555697?
Yes, KEHONG BIO provides custom synthesis services for BAS 01555697 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.