UPCMLD0ENAT0514-4730:001
TL;DR: UPCMLD0ENAT0514-4730:001 (CAS 637746-99-7) is a chemical compound with molecular formula C34H29NO6 and molecular weight 547.20 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)-6-ethyl-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate
Also Known As: UPCMLD0ENAT0514-4730:001, (3-(2H,3H,4H-benzo[b]1,4-dioxepan-7-yl)-6-ethyl-2-methyl-4-oxochromen-7-yloxy) -N,N-dibenzamide, [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate, 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-6-ethyl-2-methyl-4-oxo-4H-chromen-7-yl diphenylcarbamate
| Molecular Formula | C34H29NO6 |
|---|---|
| Molecular Weight | 547.20 g/mol |
| LogP | 7.82922 |
| Topological Polar Surface Area | 78.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 547.19946 |
| Heavy Atoms | 41 |
| Complexity | 1739.607 |
Chemical Identifiers
| CAS Number | 637746-99-7 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)OC(=C(C2=O)C5=CC6=C(C=C5)OCCCO6)C |
Product Overview
UPCMLD0ENAT0514-4730:001 (CAS 637746-99-7), with molecular formula C34H29NO6 and molecular weight 547.20 g/mol. IUPAC: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxochromen-7-yl] N,N-diphenylcarbamate.
Chemical Property Profile of UPCMLD0ENAT0514-4730:001
Property Insights of UPCMLD0ENAT0514-4730:001
The XLogP value of 7.82922 indicates that UPCMLD0ENAT0514-4730:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.21 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0514-4730:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0514-4730:001 has 0 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 UPCMLD0ENAT0514-4730:001?
The CAS number of UPCMLD0ENAT0514-4730:001 is 637746-99-7.
What is the molecular formula of UPCMLD0ENAT0514-4730:001?
The molecular formula of UPCMLD0ENAT0514-4730:001 is C34H29NO6.
What is the molecular weight of UPCMLD0ENAT0514-4730:001?
The molecular weight of UPCMLD0ENAT0514-4730:001 is 547.20 g/mol.
Where can I buy UPCMLD0ENAT0514-4730:001?
You can request a quote for UPCMLD0ENAT0514-4730:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0514-4730:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0514-4730:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.