![2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide structure](/static/products/1346/134615-47-7.webp)
2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide
TL;DR: 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide (CAS 134615-47-7) is a chemical compound with molecular formula C20H22ClNS2 and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)sulfanyl]-1-methylpiperidine
Also Known As: NCI60_011756, 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide, 4-((2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)thio)-1-methylpiperidine, 4-[(2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)sulfanyl]-1-methylpiperidine, 4-[(2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)thio]-1-methylpiperidine
| Molecular Formula | C20H22ClNS2 |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.08823 |
| Heavy Atoms | 24 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 134615-47-7 |
|---|---|
| SMILES | CN1CCC(CC1)SC2CC3=C(C=CC(=C3)Cl)SC4=CC=CC=C24 |
| InChIKey | JZNJGOKDPVHBAX-UHFFFAOYSA-N |
Product Overview
2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide (CAS 134615-47-7), with molecular formula C20H22ClNS2 and molecular weight 375.09 g/mol. IUPAC: 4-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)sulfanyl]-1-methylpiperidine.
Chemical Property Profile of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide
Property Insights of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide
The XLogP value of 5.7 indicates that 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.8 Ų, 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide?
The CAS number of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide is 134615-47-7.
What is the molecular formula of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide?
The molecular formula of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide is C20H22ClNS2.
What is the molecular weight of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide?
The molecular weight of 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide is 375.09 g/mol.
Where can I buy 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide?
You can request a quote for 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl 1-methyl-4-piperidinyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.