![4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one structure](/static/products/6632/663204-59-9.webp)
4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one
TL;DR: 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one (CAS 663204-59-9) is a chemical compound with molecular formula C29H29N5O5 and molecular weight 527.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one
Also Known As: 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one, 4-methyl-2-[2-nitro-5-(4-{[3-(propan-2-yloxy)phenyl]carbonyl}piperazin-1-yl)phenyl]phthalazin-1(2H)-one
| Molecular Formula | C29H29N5O5 |
|---|---|
| Molecular Weight | 527.22 g/mol |
| LogP | 4.35192 |
| Topological Polar Surface Area | 110.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 527.21686 |
| Heavy Atoms | 39 |
| Complexity | 1622.4556 |
Chemical Identifiers
| CAS Number | 663204-59-9 |
|---|---|
| SMILES | CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)OC(C)C)[N+](=O)[O-] |
Product Overview
4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one (CAS 663204-59-9), with molecular formula C29H29N5O5 and molecular weight 527.22 g/mol. IUPAC: 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one.
Chemical Property Profile of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one
Property Insights of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one
The XLogP value of 4.35192 indicates that 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one. Following Lipinski's Rule of Five, 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one 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 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one?
The CAS number of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one is 663204-59-9.
What is the molecular formula of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one?
The molecular formula of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one is C29H29N5O5.
What is the molecular weight of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one?
The molecular weight of 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one is 527.22 g/mol.
Where can I buy 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one?
You can request a quote for 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-[2-nitro-5-[4-(3-propan-2-yloxybenzoyl)piperazin-1-yl]phenyl]phthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.