Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate
TL;DR: Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate (CAS 72083-53-5) is a chemical compound with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(4-methylpyrrolo[3,2-d][1,3]thiazol-2-yl)carbamate
Also Known As: Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate, 4H-Pyrrolo[3,2-d]thiazole,carbamic acid deriv., ethyl N-(4-methylpyrrolo[3,2-d][1,3]thiazol-2-yl)carbamate, Ethyl (4-methyl-4H-pyrrolo[3,2-d]thiazol-2-yl)carbamate, ethyl N-(4-methylpyrrolo[3,2-d]thiazol-2-yl)carbamate
| Molecular Formula | C9H11N3O2S |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.0572 |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 72083-53-5 |
|---|---|
| SMILES | CCOC(=O)NC1=NC2=C(S1)N(C=C2)C |
| InChIKey | LSQDBHRMANDFSV-UHFFFAOYSA-N |
Product Overview
Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate (CAS 72083-53-5), with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol. IUPAC: ethyl N-(4-methylpyrrolo[3,2-d][1,3]thiazol-2-yl)carbamate.
Chemical Property Profile of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate
Property Insights of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate. Following Lipinski's Rule of Five, Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate has 1 hydrogen bond donor(s) and 4 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 Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate?
The CAS number of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate is 72083-53-5.
What is the molecular formula of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate?
The molecular formula of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate is C9H11N3O2S.
What is the molecular weight of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate?
The molecular weight of Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate is 225.06 g/mol.
Where can I buy Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate?
You can request a quote for Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-methyl-4H-pyrrolo(3,2-d)(1,3)thiazol-2-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.