UPCMLD0ENAT5961995:001
TL;DR: UPCMLD0ENAT5961995:001 (CAS 371137-39-2) is a chemical compound with molecular formula C27H29N3O4 and molecular weight 459.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Also Known As: UPCMLD0ENAT5961995:001, 1-(3-(1H-imidazol-1-yl)propyl)-3-hydroxy-4-(4-isopropoxybenzoyl)-5-(p-tolyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione, (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(1H-imidazol-1-yl)propyl]-5-(4-methylphenyl)pyrrolidine-2,3-dione, 3-hydroxy-1-(3-imidazolylpropyl)-4-{[4-(methylethoxy)phenyl]carbonyl}-5-(4-met hylphenyl)-3-pyrrolin-2-one
| Molecular Formula | C27H29N3O4 |
|---|---|
| Molecular Weight | 459.22 g/mol |
| LogP | 4.49072 |
| Topological Polar Surface Area | 84.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.21582 |
| Heavy Atoms | 34 |
| Complexity | 1179.6278 |
Chemical Identifiers
| CAS Number | 371137-39-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C(=O)N2CCCN4C=CN=C4 |
Product Overview
UPCMLD0ENAT5961995:001 (CAS 371137-39-2), with molecular formula C27H29N3O4 and molecular weight 459.22 g/mol. IUPAC: (4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of UPCMLD0ENAT5961995:001
Property Insights of UPCMLD0ENAT5961995:001
The XLogP value of 4.49072 indicates that UPCMLD0ENAT5961995:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.66 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5961995:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5961995:001 has 1 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT5961995:001?
The CAS number of UPCMLD0ENAT5961995:001 is 371137-39-2.
What is the molecular formula of UPCMLD0ENAT5961995:001?
The molecular formula of UPCMLD0ENAT5961995:001 is C27H29N3O4.
What is the molecular weight of UPCMLD0ENAT5961995:001?
The molecular weight of UPCMLD0ENAT5961995:001 is 459.22 g/mol.
Where can I buy UPCMLD0ENAT5961995:001?
You can request a quote for UPCMLD0ENAT5961995:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5961995:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5961995:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.