UPCMLD0ENAT0507-6198:001
TL;DR: UPCMLD0ENAT0507-6198:001 (CAS 5821-06-7) is a chemical compound with molecular formula C32H33N3O5S and molecular weight 571.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(3,4-dimethoxyphenyl)-2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: UPCMLD0ENAT0507-6198:001, ETHYL (8E)-2-(3,4-DIMETHOXYPHENYL)-8-[[2,5-DIMETHYL-1-(4-METHYLPHENYL)PYRROL-3-YL]METHYLIDENE]-4-METHYL-9-OXO-7-THIA-1,5-DIAZABICYCLO[4.3.0]NONA-3,5-DIENE-3-CARBOXYLATE, ethyl 5-(3,4-dimethoxyphenyl)-2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C32H33N3O5S |
|---|---|
| Molecular Weight | 571.21 g/mol |
| LogP | 4.53146 |
| Topological Polar Surface Area | 84.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 571.2141 |
| Heavy Atoms | 41 |
| Complexity | 1858.3208 |
Chemical Identifiers
| CAS Number | 5821-06-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=C(N(C(=C4)C)C5=CC=C(C=C5)C)C)S2)C |
Product Overview
UPCMLD0ENAT0507-6198:001 (CAS 5821-06-7), with molecular formula C32H33N3O5S and molecular weight 571.21 g/mol. IUPAC: ethyl 5-(3,4-dimethoxyphenyl)-2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of UPCMLD0ENAT0507-6198:001
Property Insights of UPCMLD0ENAT0507-6198:001
The XLogP value of 4.53146 indicates that UPCMLD0ENAT0507-6198:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.05 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0507-6198:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0507-6198:001 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0507-6198:001?
The CAS number of UPCMLD0ENAT0507-6198:001 is 5821-06-7.
What is the molecular formula of UPCMLD0ENAT0507-6198:001?
The molecular formula of UPCMLD0ENAT0507-6198:001 is C32H33N3O5S.
What is the molecular weight of UPCMLD0ENAT0507-6198:001?
The molecular weight of UPCMLD0ENAT0507-6198:001 is 571.21 g/mol.
Where can I buy UPCMLD0ENAT0507-6198:001?
You can request a quote for UPCMLD0ENAT0507-6198:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0507-6198:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0507-6198:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.