2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride
TL;DR: 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride (CAS 121942-99-2) is a chemical compound with molecular formula C26H29ClN4OS2 and molecular weight 512.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[4-(5,10-dihydrothieno[2,3-c][2]benzothiepin-10-yl)piperazin-1-yl]propyl]-1H-benzimidazol-2-one;hydrochloride
Also Known As: 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride, 1-{3-[4-(4,9-Dihydrothieno[2,3-c][2]benzothiepin-4-yl)piperazin-1-yl]propyl}-1H-1,3-benzimidazol-2-ol--hydrogen chloride (1/1), 1-{3-[4-(4,9-Dihydrothieno[2,3-c][2]benzothiepin-4-yl)piperazin-1-yl]propyl}-1H-benzimidazol-2-ol--hydrogen chloride (1/1), 3-[3-[4-(5,10-dihydrothieno[2,3-c][2]benzothiepin-10-yl)piperazin-1-yl]propyl]-1H-benzimidazol-2-one hydrochloride, RefChem:268484
| Molecular Formula | C26H29ClN4OS2 |
|---|---|
| Molecular Weight | 512.15 g/mol |
| LogP | 5.2159 |
| Topological Polar Surface Area | 44.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.14716 |
| Heavy Atoms | 34 |
| Complexity | 1321.5918 |
Chemical Identifiers
| CAS Number | 121942-99-2 |
|---|---|
| SMILES | C1CN(CCN1CCCN2C3=CC=CC=C3NC2=O)C4C5=C(SCC6=CC=CC=C46)SC=C5.Cl |
Product Overview
2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride (CAS 121942-99-2), with molecular formula C26H29ClN4OS2 and molecular weight 512.15 g/mol. IUPAC: 3-[3-[4-(5,10-dihydrothieno[2,3-c][2]benzothiepin-10-yl)piperazin-1-yl]propyl]-1H-benzimidazol-2-one;hydrochloride.
Chemical Property Profile of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride
Property Insights of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride
The XLogP value of 5.2159 indicates that 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.27 Ų, 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride?
The CAS number of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride is 121942-99-2.
What is the molecular formula of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride?
The molecular formula of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride is C26H29ClN4OS2.
What is the molecular weight of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride?
The molecular weight of 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride is 512.15 g/mol.
Where can I buy 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride?
You can request a quote for 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(4,9-dihydrothieno(2,3-c)(2)benzothiepin-4-yl)-1-piperazinyl)propyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.