RefChem:337047
TL;DR: RefChem:337047 (CAS 7200-23-9) is a chemical compound with molecular formula C18H23N3O2S and molecular weight 345.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-(6-methyl-5,5-dioxobenzo[c][1,2,5]benzothiadiazepin-11-yl)propan-1-amine
Also Known As: Dibenzo(1,2,5)thiadiazepine, 6,11-dihydro-11-(3-(dimethylamino)propyl)-6-methyl-, 5,5-dioxide, 11-(3-(Dimethylamino)propyl)-6-methyl-6,11-dihydrodibenzo(1,2,5)thiadiazepine 5,5-dioxide, 6-Methyl 11 (3-dimethylaminopropyl)dibenzo(c.f)(1,2,5)thiadiazepine 5,5-dioxyde [French], 6-Methyl 11 (3-dimethylaminopropyl)dibenzo(c.f)(1,2,5)thiadiazepine 5,5-dioxyde, N,N-dimethyl-3-(6-methyl-5,5-dioxobenzo[c][1,2,5]benzothiadiazepin-11-yl)propan-1-amine
| Molecular Formula | C18H23N3O2S |
|---|---|
| Molecular Weight | 345.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 52.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.1511 |
| Heavy Atoms | 24 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 7200-23-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N(C3=CC=CC=C3S1(=O)=O)CCCN(C)C |
| InChIKey | NUTAJVOJTUOPHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:337047 (CAS 7200-23-9), with molecular formula C18H23N3O2S and molecular weight 345.15 g/mol. IUPAC: N,N-dimethyl-3-(6-methyl-5,5-dioxobenzo[c][1,2,5]benzothiadiazepin-11-yl)propan-1-amine.
Chemical Property Profile of RefChem:337047
Property Insights of RefChem:337047
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:337047. With a topological polar surface area (TPSA) of 52.2 Ų, RefChem:337047 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:337047 has 0 hydrogen bond donor(s) and 5 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 RefChem:337047?
The CAS number of RefChem:337047 is 7200-23-9.
What is the molecular formula of RefChem:337047?
The molecular formula of RefChem:337047 is C18H23N3O2S.
What is the molecular weight of RefChem:337047?
The molecular weight of RefChem:337047 is 345.15 g/mol.
Where can I buy RefChem:337047?
You can request a quote for RefChem:337047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:337047?
Yes, KEHONG BIO provides custom synthesis services for RefChem:337047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.