14-[(1H-imidazol-4-yl)methylidene]-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.0¹,¹³.0³,?]hexadeca-3,5,7-triene-11,12,15-trione

14-[(1H-imidazol-4-yl)methylidene]-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.0¹,¹³.0³,?]hexadeca-3,5,7-triene-11,12,15-trione

CAS: 71751-77-4

Formula: C23H23N5O4

SMILES: CON1C2=CC=CC=C2C2(CC(=O)C(=O)N3C(=CC4=CNC=N4)C(=O)NC123)C(C)(C)C=C

IUPAC: 14-[(1H-imidazol-4-yl)methylidene]-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.0¹,¹³.0³,?]hexadeca-3,5,7-triene-11,12,15-trione

InChI: InChI=1/C23H23N5O4/c1-5-21(2,3)22-11-18(29)20(31)27-17(10-14-12-24-13-25-14)19(30)26-23(22,27)28(32-4)16-9-7-6-8-15(16)22/h5-10,12-13H,1,11H2,2-4H3,(H,24,25)(H,26,30)

Composition: C (63.73%), H (5.35%), N (16.16%), O (14.76%)

Molar Mass: 433.468

Atom Count: 55

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	433.175004241
Formal Charge	0
FSP3	0.3
Hetero Ring Count	4
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	JNTXZCAYFJHPJL-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	127.86
Topological Polar Surface Area	107.63
Polarizability	44.2
Ring Count	5
Rotatable Bond Count	4

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98%	<7 Days	71751-77-4		$812.48-$1,415.88$812.48$1,415.88