3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate
TL;DR: 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate (CAS 618389-30-3) is a chemical compound with molecular formula C30H20N2O4S and molecular weight 504.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate
Also Known As: (3-benzothiazol-2-yl-2-methyl-4-oxochromen-7-yloxy)-N,N-dibenzamide, 3-(benzo[d]thiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate, [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate, 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate
| Molecular Formula | C30H20N2O4S |
|---|---|
| Molecular Weight | 504.11 g/mol |
| LogP | 7.71522 |
| Topological Polar Surface Area | 72.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 504.11438 |
| Heavy Atoms | 37 |
| Complexity | 1738.2244 |
Chemical Identifiers
| CAS Number | 618389-30-3 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC6=CC=CC=C6S5 |
Product Overview
3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate (CAS 618389-30-3), with molecular formula C30H20N2O4S and molecular weight 504.11 g/mol. IUPAC: [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate.
Chemical Property Profile of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate
Property Insights of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate
The XLogP value of 7.71522 indicates that 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate. Following Lipinski's Rule of Five, 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate?
The CAS number of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate is 618389-30-3.
What is the molecular formula of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate?
The molecular formula of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate is C30H20N2O4S.
What is the molecular weight of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate?
The molecular weight of 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate is 504.11 g/mol.
Where can I buy 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate?
You can request a quote for 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.