RefChem:204362
TL;DR: RefChem:204362 (CAS 106000-45-7) is a chemical compound with molecular formula C22H24N4O6S2 and molecular weight 504.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,8,18,21,24-hexaoxa-12,28-dithia-14,30-diazapentacyclo[23.7.0.09,17.011,15.027,31]dotriaconta-1(25),9(17),10,13,15,26,29,31-octaene-13,29-diamine
Also Known As: cis-2,14-Diaminodibenzothiazolo(6,5-b;6,5-k)-18-crown-6, (1,4,7,10,13,16)Hexaoxacyclooctadecino(2,3-f:11,12-f')bisbenzothiazole-2,14-diamine, 6,7,9,10,18,19,21,22-octahydro-, cis-2,14-diaminodibenzothiazolo(6,5-b,6,5-k)-18-crown-6, 6,7,9,10,18,19,21,22-Octahydro[1,3]thiazolo[4',5':18,19][1,4,7,10,13,16]benzohexaoxacyclooctadecino[8,9-f][1,3]benzothiazole-2,14-diamine, 6,7,9,10,18,19,21,22-octahydro[1,3]thiazolo[4',5':18,19][1,4,7,10,13,16]benzohexaoxacyclooctadecino[8,9-f][1,3]benzothiazole-2,14-diamine(non-preferred name)
| Molecular Formula | C22H24N4O6S2 |
|---|---|
| Molecular Weight | 504.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 190.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 0 |
| Exact Mass | 504.11374 |
| Heavy Atoms | 34 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 106000-45-7 |
|---|---|
| SMILES | C1COC2=C(C=C3C(=C2)N=C(S3)N)OCCOCCOC4=C(C=C5C(=C4)N=C(S5)N)OCCO1 |
| InChIKey | XZYSFYOWJFAIRH-UHFFFAOYSA-N |
Product Overview
RefChem:204362 (CAS 106000-45-7), with molecular formula C22H24N4O6S2 and molecular weight 504.11 g/mol. IUPAC: 2,5,8,18,21,24-hexaoxa-12,28-dithia-14,30-diazapentacyclo[23.7.0.09,17.011,15.027,31]dotriaconta-1(25),9(17),10,13,15,26,29,31-octaene-13,29-diamine.
Chemical Property Profile of RefChem:204362
Property Insights of RefChem:204362
The XLogP value of 3.2 indicates that RefChem:204362 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 190.0 Ų indicates high polarity, suggesting RefChem:204362 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:204362 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:204362?
The CAS number of RefChem:204362 is 106000-45-7.
What is the molecular formula of RefChem:204362?
The molecular formula of RefChem:204362 is C22H24N4O6S2.
What is the molecular weight of RefChem:204362?
The molecular weight of RefChem:204362 is 504.11 g/mol.
Where can I buy RefChem:204362?
You can request a quote for RefChem:204362 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:204362?
Yes, KEHONG BIO provides custom synthesis services for RefChem:204362 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.