UPCMLD0ENAT0514-4755:001
TL;DR: UPCMLD0ENAT0514-4755:001 (CAS 618389-16-5) is a chemical compound with molecular formula C32H32O9 and molecular weight 560.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propylchromen-7-yl] 3,4,5-trimethoxybenzoate
Also Known As: UPCMLD0ENAT0514-4755:001, [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propylchromen-7-yl] 3,4,5-trimethoxybenzoate, 3-(2H,3H,4H-benzo[b]1,4-dioxepan-7-yl)-2-methyl-4-oxo-6-propylchromen-7-yl 3,4 ,5-trimethoxybenzoate, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl 3,4,5-trimethoxybenzoate, 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl 3,4,5-trimethoxybenzoate
| Molecular Formula | C32H32O9 |
|---|---|
| Molecular Weight | 560.20 g/mol |
| LogP | 6.12722 |
| Topological Polar Surface Area | 102.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 560.20465 |
| Heavy Atoms | 41 |
| Complexity | 1643.5709 |
Chemical Identifiers
| CAS Number | 618389-16-5 |
|---|---|
| SMILES | CCCC1=CC2=C(C=C1OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)OC(=C(C2=O)C4=CC5=C(C=C4)OCCCO5)C |
Product Overview
UPCMLD0ENAT0514-4755:001 (CAS 618389-16-5), with molecular formula C32H32O9 and molecular weight 560.20 g/mol. IUPAC: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propylchromen-7-yl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of UPCMLD0ENAT0514-4755:001
Property Insights of UPCMLD0ENAT0514-4755:001
The XLogP value of 6.12722 indicates that UPCMLD0ENAT0514-4755:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.66 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0514-4755:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0514-4755:001 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0514-4755:001?
The CAS number of UPCMLD0ENAT0514-4755:001 is 618389-16-5.
What is the molecular formula of UPCMLD0ENAT0514-4755:001?
The molecular formula of UPCMLD0ENAT0514-4755:001 is C32H32O9.
What is the molecular weight of UPCMLD0ENAT0514-4755:001?
The molecular weight of UPCMLD0ENAT0514-4755:001 is 560.20 g/mol.
Where can I buy UPCMLD0ENAT0514-4755:001?
You can request a quote for UPCMLD0ENAT0514-4755:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0514-4755:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0514-4755:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.