2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride
TL;DR: 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride (CAS 145232-74-2) is a chemical compound with molecular formula C30H30ClN3O3S and molecular weight 547.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-9,10-dioxoanthracene-2-carboxamide;hydrochloride
Also Known As: 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride, N-[2- ethylthiocarbamoyl]-9,10-dioxo-anthracene-2-carboxamidehydrochloride, N-[2-(1-benzyl-4-piperidyl)ethylthiocarbamoyl]-9,10-dioxo-anthracene-2 -carboxamide hydrochloride, N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-9,10-dioxoanthracene-2-carboxamide;hydrochloride, N-[2-(1-benzyl-4-piperidyl)ethylthiocarbamoyl]-9,10-dioxo-anthracene-2-carboxamide Hydrochloride
| Molecular Formula | C30H30ClN3O3S |
|---|---|
| Molecular Weight | 547.17 g/mol |
| LogP | 4.7904 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 547.1696 |
| Heavy Atoms | 38 |
| Complexity | 1353.8589 |
Chemical Identifiers
| CAS Number | 145232-74-2 |
|---|---|
| SMILES | C1CN(CCC1CCNC(=S)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)CC5=CC=CC=C5.Cl |
Product Overview
2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride (CAS 145232-74-2), with molecular formula C30H30ClN3O3S and molecular weight 547.17 g/mol. IUPAC: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-9,10-dioxoanthracene-2-carboxamide;hydrochloride.
Chemical Property Profile of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride
Property Insights of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride
The XLogP value of 4.7904 indicates that 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride. Following Lipinski's Rule of Five, 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride has 2 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 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride?
The CAS number of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride is 145232-74-2.
What is the molecular formula of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride?
The molecular formula of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride is C30H30ClN3O3S.
What is the molecular weight of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride?
The molecular weight of 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride is 547.17 g/mol.
Where can I buy 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride?
You can request a quote for 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Anthracenecarboxamide, 9,10-dihydro-19,10-dioxo-N-(((2-(1-(phenylmethyl)-4-piperidinyl)ethyl)amino)thioxomethyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.