N-[2-({1-[(4-acetylphenyl)carbamoyl]propyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide

N-[2-({1-[(4-acetylphenyl)carbamoyl]propyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide

Formula: C26H23N3O3S2

SMILES: CCC(SC1=NC2=CC=C(NC(=O)C3=CC=CC=C3)C=C2S1)C(=O)NC1=CC=C(C=C1)C(C)=O

IUPAC: N-[2-({1-[(4-acetylphenyl)carbamoyl]propyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide

InChI: InChI=1/C26H23N3O3S2/c1-3-22(25(32)27-19-11-9-17(10-12-19)16(2)30)33-26-29-21-14-13-20(15-23(21)34-26)28-24(31)18-7-5-4-6-8-18/h4-15,22H,3H2,1-2H3,(H,27,32)(H,28,31)

Composition: C (63.78%), H (4.74%), N (8.58%), O (9.80%), S (13.10%)

Molar Mass: 489.61

Atom Count: 57

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	489.118083961
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	KKSNQAZXUPHJIA-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	138.82
Topological Polar Surface Area	88.16
Polarizability	53.2
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H23N3O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00