Noctran
TL;DR: Noctran (CAS 78355-48-3) is a chemical compound with molecular formula C54H55ClK2N6O6S2 and molecular weight 1060.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipotassium;7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate;1-[10-[2-(dimethylamino)propyl]phenothiazin-2-yl]ethanone;1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]ethanone;hydroxide
Also Known As: Noctran, FA 522 A, 3-ketotetrafluoroglutaroyl fluoride, Acepromazine mixture with aceprometazine and chlorazepate, 1H-1,4-Benzodiazepine-3-carboxylic acid, 7-chloro-2,3-dihydro-2-oxo-5-phenyl-, monopotassium salt, mixture with 1-(10-(2-(dimethylamino)propyl)-10H-phenothiazin-2-yl)ethanone, 1-(10-(3-(dimethylamino)propyl)-10H-phenothiazin-2-yl)ethanone and potassium hydroxide
| Molecular Formula | C54H55ClK2N6O6S2 |
|---|---|
| Molecular Weight | 1060.26 g/mol |
| LogP | 3.9648 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 1060.2587 |
| Heavy Atoms | 71 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 78355-48-3 |
|---|---|
| SMILES | CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)C)N(C)C.CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C.C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)[O-].[OH-].[K+].[K+] |
| InChIKey | NXSHRUCPQPNTAW-UHFFFAOYSA-L |
Product Overview
Noctran (CAS 78355-48-3), with molecular formula C54H55ClK2N6O6S2 and molecular weight 1060.26 g/mol. IUPAC: dipotassium;7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate;1-[10-[2-(dimethylamino)propyl]phenothiazin-2-yl]ethanone;1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]ethanone;hydroxide.
Chemical Property Profile of Noctran
Property Insights of Noctran
The XLogP value of 3.9648 indicates that Noctran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting Noctran may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Noctran has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Noctran?
The CAS number of Noctran is 78355-48-3.
What is the molecular formula of Noctran?
The molecular formula of Noctran is C54H55ClK2N6O6S2.
What is the molecular weight of Noctran?
The molecular weight of Noctran is 1060.26 g/mol.
Where can I buy Noctran?
You can request a quote for Noctran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Noctran?
Yes, KEHONG BIO provides custom synthesis services for Noctran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.