BAS 07100868
TL;DR: BAS 07100868 (CAS 577998-82-4) is a chemical compound with molecular formula C16H18N4O4S and molecular weight 362.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetyl-1'-ethyl-5'-methoxy-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide
Also Known As: BAS 07100868, A3448/0146398, N-(4-acetyl-1'-ethyl-5'-methoxy-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide, N-(3'-acetyl-1-ethyl-5-methoxy-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide, {N}-(3'-ACETYL-1-ETHYL-5-METHOXY-2-OXO-1,2-DIHYDRO-3'{H}-SPIRO[INDOLE-3,2'-[1,3,4]THIADIAZOL]-5'-YL)ACETAMIDE
| Molecular Formula | C16H18N4O4S |
|---|---|
| Molecular Weight | 362.10 g/mol |
| LogP | 1.2169 |
| Topological Polar Surface Area | 91.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.1049 |
| Heavy Atoms | 25 |
| Complexity | 809.3245 |
Chemical Identifiers
| CAS Number | 577998-82-4 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)OC)C3(C1=O)N(N=C(S3)NC(=O)C)C(=O)C |
Product Overview
BAS 07100868 (CAS 577998-82-4), with molecular formula C16H18N4O4S and molecular weight 362.10 g/mol. IUPAC: N-(4-acetyl-1'-ethyl-5'-methoxy-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide.
Chemical Property Profile of BAS 07100868
Property Insights of BAS 07100868
The XLogP value of 1.2169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07100868. The TPSA of 91.31 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07100868. Following Lipinski's Rule of Five, BAS 07100868 has 1 hydrogen bond donor(s) and 6 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 07100868?
The CAS number of BAS 07100868 is 577998-82-4.
What is the molecular formula of BAS 07100868?
The molecular formula of BAS 07100868 is C16H18N4O4S.
What is the molecular weight of BAS 07100868?
The molecular weight of BAS 07100868 is 362.10 g/mol.
Where can I buy BAS 07100868?
You can request a quote for BAS 07100868 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07100868?
Yes, KEHONG BIO provides custom synthesis services for BAS 07100868 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.