N2,N4-bis(4-chloro-3-methylphenyl)-6-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3,5-triazine-2,4-diamine

N2,N4-bis(4-chloro-3-methylphenyl)-6-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3,5-triazine-2,4-diamine

Formula: C26H22Cl2N6OS2

SMILES: CCOC1=CC=C2N=C(SC3=NC(NC4=CC=C(Cl)C(C)=C4)=NC(NC4=CC=C(Cl)C(C)=C4)=N3)SC2=C1

IUPAC: N2,N4-bis(4-chloro-3-methylphenyl)-6-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3,5-triazine-2,4-diamine

InChI: InChI=1S/C26H22Cl2N6OS2/c1-4-35-18-7-10-21-22(13-18)36-26(31-21)37-25-33-23(29-16-5-8-19(27)14(2)11-16)32-24(34-25)30-17-6-9-20(28)15(3)12-17/h5-13H,4H2,1-3H3,(H2,29,30,32,33,34)

Composition: C (54.83%), H (3.89%), Cl (12.45%), N (14.76%), O (2.81%), S (11.26%)

Molar Mass: 569.52

Atom Count: 59

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	568.0673571
Formal Charge	0
FSP3	0.15
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	AESCQHCLXRKCOG-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	153.46
Topological Polar Surface Area	84.85
Polarizability	58.69
Ring Count	5
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H22Cl2N6OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00