BAS 00107588
TL;DR: BAS 00107588 (CAS 306316-83-6) is a chemical compound with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one
Also Known As: BAS 00107588, 3-Ethyl-5-(5-methoxy-3-methyl-3H-benzothiazol-2-ylidene)-2-p-tolylimino-thiazolidin-4-one, (2Z,5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one, (2Z,5Z)-3-ethyl-5-(5-methoxy-3-methylbenzo[d]thiazol-2(3H)-ylidene)-2-(p-tolylimino)thiazolidin-4-one, (5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one
| Molecular Formula | C21H21N3O2S2 |
|---|---|
| Molecular Weight | 411.11 g/mol |
| LogP | 4.99762 |
| Topological Polar Surface Area | 45.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 411.1075 |
| Heavy Atoms | 28 |
| Complexity | 999.2103 |
Chemical Identifiers
| CAS Number | 306316-83-6 |
|---|---|
| SMILES | CCN1C(=O)/C(=C/2\N(C3=C(S2)C=CC(=C3)OC)C)/SC1=NC4=CC=C(C=C4)C |
Product Overview
BAS 00107588 (CAS 306316-83-6), with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol. IUPAC: (5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)imino-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00107588
Property Insights of BAS 00107588
The XLogP value of 4.99762 indicates that BAS 00107588 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.14 Ų, BAS 00107588 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00107588 has 0 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 00107588?
The CAS number of BAS 00107588 is 306316-83-6.
What is the molecular formula of BAS 00107588?
The molecular formula of BAS 00107588 is C21H21N3O2S2.
What is the molecular weight of BAS 00107588?
The molecular weight of BAS 00107588 is 411.11 g/mol.
Where can I buy BAS 00107588?
You can request a quote for BAS 00107588 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00107588?
Yes, KEHONG BIO provides custom synthesis services for BAS 00107588 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.