![5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester structure](/static/products/4985/498535-77-6.webp)
5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester
TL;DR: 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester (CAS 498535-77-6) is a chemical compound with molecular formula C23H18N2O5S and molecular weight 434.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-(phenothiazine-10-carbonylamino)benzene-1,3-dicarboxylate
Also Known As: ChemDiv3_005927, IDI1_023837, BAS 05289272, 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester, BRD-K89620541-001-01-8
| Molecular Formula | C23H18N2O5S |
|---|---|
| Molecular Weight | 434.09 g/mol |
| LogP | 5.0946 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.09363 |
| Heavy Atoms | 31 |
| Complexity | 1114.3392 |
Chemical Identifiers
| CAS Number | 498535-77-6 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)NC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C(=O)OC |
Product Overview
5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester (CAS 498535-77-6), with molecular formula C23H18N2O5S and molecular weight 434.09 g/mol. IUPAC: dimethyl 5-(phenothiazine-10-carbonylamino)benzene-1,3-dicarboxylate.
Chemical Property Profile of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester
Property Insights of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester
The XLogP value of 5.0946 indicates that 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester. Following Lipinski's Rule of Five, 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester has 1 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 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester?
The CAS number of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester is 498535-77-6.
What is the molecular formula of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester?
The molecular formula of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester is C23H18N2O5S.
What is the molecular weight of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester?
The molecular weight of 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester is 434.09 g/mol.
Where can I buy 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester?
You can request a quote for 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Phenothiazine-10-carbonyl)-amino]-isophthalic acid dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.