Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-
TL;DR: Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- (CAS 6550-57-8) is a chemical compound with molecular formula C18H20ClN3S and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(8-chlorobenzo[b][1,4]benzothiazepin-6-yl)methyl]-N',N'-dimethylethane-1,2-diamine
Also Known As: DIBENZO(b,f)(1,4)THIAZEPINE, 2-CHLORO-11-((2-DIMETHYLAMINOETHYL)METHYLAMINO)-, 2-Chloro-11-((2-dimethylaminoethyl)methylamino)dibenzo(b,f)(1,4)thiazepine, N-[(8-chlorobenzo[b][1,4]benzothiazepin-6-yl)methyl]-N',N'-dimethylethane-1,2-diamine, DIBENZO(b,f)(1,4)THIAZEPINE,2-CHLORO-11-((2-DIMETHYLAMINOETHYL)METHYLAMINO), N~2~-[(2-Chlorodibenzo[b,f][1,4]thiazepin-11-yl)methyl]-N~1~,N~1~-dimethylethane-1,2-diamine
| Molecular Formula | C18H20ClN3S |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.10666 |
| Heavy Atoms | 23 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 6550-57-8 |
|---|---|
| SMILES | CN(C)CCNCC1=NC2=CC=CC=C2SC3=C1C=C(C=C3)Cl |
| InChIKey | LGFFMPBXQOPBMN-UHFFFAOYSA-N |
Product Overview
Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- (CAS 6550-57-8), with molecular formula C18H20ClN3S and molecular weight 345.11 g/mol. IUPAC: N-[(8-chlorobenzo[b][1,4]benzothiazepin-6-yl)methyl]-N',N'-dimethylethane-1,2-diamine.
Chemical Property Profile of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-
Property Insights of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-
The XLogP value of 3.7 indicates that Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- has 1 hydrogen bond donor(s) and 4 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 Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-?
The CAS number of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- is 6550-57-8.
What is the molecular formula of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-?
The molecular formula of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- is C18H20ClN3S.
What is the molecular weight of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-?
The molecular weight of Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- is 345.11 g/mol.
Where can I buy Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-?
You can request a quote for Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-((2-dimethylaminoethyl)methylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.