(5E)-1-[4-(adamantan-1-yl)phenyl]-5-{[5-(dimethylamino)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

(5E)-1-[4-(adamantan-1-yl)phenyl]-5-{[5-(dimethylamino)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

Formula: C27H29N3O4

SMILES: CN(C)C1=CC=C(O1)C=C1/C(=O)NC(=O)N(C1=O)C1=CC=C(C=C1)C12CC3CC(CC(C3)C1)C2

IUPAC: (5E)-1-[4-(adamantan-1-yl)phenyl]-5-{[5-(dimethylamino)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C27H29N3O4/c1-29(2)23-8-7-21(34-23)12-22-24(31)28-26(33)30(25(22)32)20-5-3-19(4-6-20)27-13-16-9-17(14-27)11-18(10-16)15-27/h3-8,12,16-18H,9-11,13-15H2,1-2H3,(H,28,31,33)/b22-12+

Composition: C (70.57%), H (6.36%), N (9.14%), O (13.93%)

Molar Mass: 459.546

Atom Count: 63

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	459.215806426
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DJAPXYCNFWSGKB-WSDLNYQXSA-N
Lipinski's Rule of Five	1
Molar Refractivity	127.58
Topological Polar Surface Area	82.86
Polarizability	48.48
Ring Count	6
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H29N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00