UPCMLD0ENAT0500-0426:001
TL;DR: UPCMLD0ENAT0500-0426:001 (CAS 1396972-84-1) is a chemical compound with molecular formula C32H31NO9 and molecular weight 573.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-methyl-7-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4-oxochromen-3-yl]oxybenzoate
Also Known As: UPCMLD0ENAT0500-0426:001, methyl 4-[2-methyl-7-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4-oxochromen-3-yl]oxybenzoate, 3-[4-(methoxycarbonyl)phenoxy]-2-methyl-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)phenylalaninate, METHYL 4-{[7-({2-[(TERT-BUTOXYCARBONYL)AMINO]-3-PHENYLPROPANOYL}OXY)-2-METHYL-4-OXO-4H-CHROMEN-3-YL]OXY}BENZOATE
| Molecular Formula | C32H31NO9 |
|---|---|
| Molecular Weight | 573.20 g/mol |
| LogP | 5.72172 |
| Topological Polar Surface Area | 130.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 573.1999 |
| Heavy Atoms | 42 |
| Complexity | 1652.2115 |
Chemical Identifiers
| CAS Number | 1396972-84-1 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)OC4=CC=C(C=C4)C(=O)OC |
Product Overview
UPCMLD0ENAT0500-0426:001 (CAS 1396972-84-1), with molecular formula C32H31NO9 and molecular weight 573.20 g/mol. IUPAC: methyl 4-[2-methyl-7-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4-oxochromen-3-yl]oxybenzoate.
Chemical Property Profile of UPCMLD0ENAT0500-0426:001
Property Insights of UPCMLD0ENAT0500-0426:001
The XLogP value of 5.72172 indicates that UPCMLD0ENAT0500-0426:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.37 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0500-0426:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0500-0426:001 has 1 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 UPCMLD0ENAT0500-0426:001?
The CAS number of UPCMLD0ENAT0500-0426:001 is 1396972-84-1.
What is the molecular formula of UPCMLD0ENAT0500-0426:001?
The molecular formula of UPCMLD0ENAT0500-0426:001 is C32H31NO9.
What is the molecular weight of UPCMLD0ENAT0500-0426:001?
The molecular weight of UPCMLD0ENAT0500-0426:001 is 573.20 g/mol.
Where can I buy UPCMLD0ENAT0500-0426:001?
You can request a quote for UPCMLD0ENAT0500-0426:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0500-0426:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0500-0426:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.