RefChem:322675
TL;DR: RefChem:322675 (CAS 80785-10-0) is a chemical compound with molecular formula C29H39Cl2N3O2 and molecular weight 531.24194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dichloride
Also Known As: Benzamidine, N-(p-(3-(diisopropylamino)propoxy)phenyl)-N'-(p-methoxyphenyl)-, dihydrochloride, N-(p-(3-(Diisopropylamino)propoxy)phenyl)-N'-(p-methoxyphenyl)benzamidine dihydrochloride, 3-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dichloride, 3-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium,dichloride, 3-[4-[[(4-METHOXYPHENYL)AMINO]-PHENYL-METHYLIDENE]AZANIUMYLPHENOXY]PRO PYL-DIPROPAN-2-YL-AZANIUM DICHLORIDE
Technical Specifications
| Molecular Formula | C29H39Cl2N3O2 |
| Molecular Weight | 531.24194 g/mol |
| XLogP | -2.56 |
| Topological Polar Surface Area (TPSA) | 48.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 531.24194 Da |
| Heavy Atoms | 36 |
| Complexity | 564.0 |
| SMILES | CC(C)[NH+](CCCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC=C(C=C3)OC)C(C)C.[Cl-].[Cl-] |
| InChIKey | NZSWOCKGDRTOKT-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:322675
Property Insights of RefChem:322675
The XLogP value of -2.56 indicates that RefChem:322675 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.9 Ų, RefChem:322675 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322675 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:322675?
The CAS number of RefChem:322675 is 80785-10-0.
What is the molecular formula of RefChem:322675?
The molecular formula of RefChem:322675 is C29H39Cl2N3O2.
What is the molecular weight of RefChem:322675?
The molecular weight of RefChem:322675 is 531.24194 g/mol.
Where can I buy RefChem:322675?
You can request a quote for RefChem:322675 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:322675?
Yes, CoreyChem provides custom synthesis services for RefChem:322675 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.