![2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, structure](/static/products/7384/73844-16-3.webp)
2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,
TL;DR: 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, (CAS 73844-16-3) is a chemical compound with molecular formula C22H25N3O2S2 and molecular weight 427.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,, 2-({[2-(Pentylsulfanyl)-1,3-benzothiazol-6-yl]amino}methyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 4-[[(2-Pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C22H25N3O2S2 |
|---|---|
| Molecular Weight | 427.14 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 427.13882 |
| Heavy Atoms | 29 |
| Complexity | 657.0 |
Chemical Identifiers
| CAS Number | 73844-16-3 |
|---|---|
| SMILES | CCCCCSC1=NC2=C(S1)C=C(C=C2)NCN3C(=O)C4C5CC(C4C3=O)C=C5 |
| InChIKey | NTVUXMOOHULQEI-UHFFFAOYSA-N |
Product Overview
2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, (CAS 73844-16-3), with molecular formula C22H25N3O2S2 and molecular weight 427.14 g/mol. IUPAC: 4-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,
Property Insights of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,
The XLogP value of 5.1 indicates that 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,. Following Lipinski's Rule of Five, 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, has 1 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 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,?
The CAS number of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, is 73844-16-3.
What is the molecular formula of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,?
The molecular formula of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, is C22H25N3O2S2.
What is the molecular weight of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,?
The molecular weight of 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, is 427.14 g/mol.
Where can I buy 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,?
You can request a quote for 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7,?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-pentylsulfanyl-benzothiazol-6-ylamino)-methyl]-3a,4,7, and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.