2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(6-acetamido-1,3-benzothiazol-2-yl)acetamide

2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(6-acetamido-1,3-benzothiazol-2-yl)acetamide

Formula: C18H14ClN5O2S2

SMILES: CC(=O)NC1=CC=C2N=C(NC(=O)CSC3=NC4=CC(Cl)=CC=C4N3)SC2=C1

IUPAC: 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(6-acetamido-1,3-benzothiazol-2-yl)acetamide

InChI: InChI=1S/C18H14ClN5O2S2/c1-9(25)20-11-3-5-13-15(7-11)28-18(22-13)24-16(26)8-27-17-21-12-4-2-10(19)6-14(12)23-17/h2-7H,8H2,1H3,(H,20,25)(H,21,23)(H,22,24,26)

Composition: C (50.06%), H (3.27%), Cl (8.21%), N (16.22%), O (7.41%), S (14.85%)

Molar Mass: 431.91

Atom Count: 42

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	431.0277448
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	CPOJFTPNIOOFGS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.92
Topological Polar Surface Area	99.77
Polarizability	44.25
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H14ClN5O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00