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73819-48-4 | 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]phenyl]-1H-indole
CAS No: 73819-48-4 Catalog No: AG008PXL MDL No:
Product Description
Catalog Number:
AG008PXL
Chemical Name:
6-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]phenyl]-1H-indole
CAS Number:
73819-48-4
Molecular Formula:
C26H23N5O
Molecular Weight:
421.4937
IUPAC Name:
6-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]phenyl]-1H-indole
InChI:
InChI=1S/C26H23N5O/c1-2-20(26-29-13-14-30-26)16-24-19(1)15-23(31-24)17-3-7-21(8-4-17)32-22-9-5-18(6-10-22)25-27-11-12-28-25/h1-10,15-16,31H,11-14H2,(H,27,28)(H,29,30)
InChI Key:
TWSUYVHDYBVBRD-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)c1ccc(cc1)Oc1ccc(cc1)c1[nH]c2c(c1)ccc(c2)C1=NCCN1
Properties
Complexity:
707
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.19g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
421.504g/mol
Monoisotopic Mass:
421.19g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Time-dependent botulinum neurotoxin serotype A metalloprotease inhibitors. | Bioorganic & medicinal chemistry 20111215 |
| Antifungal and antibacterial activities of diarylamidine derivatives. | Antimicrobial agents and chemotherapy 19800801 |
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