N-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]-2-[(naphthalen-1-ylmethyl)sulfanyl]-1,3-benzothiazol-6-amine

N-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]-2-[(naphthalen-1-ylmethyl)sulfanyl]-1,3-benzothiazol-6-amine

Formula: C29H29N7O2S2

SMILES: C(SC1=NC2=CC=C(NC3=NC(=NC(=N3)N3CCOCC3)N3CCOCC3)C=C2S1)C1=CC=CC2=CC=CC=C12

IUPAC: N-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]-2-{[(naphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-amine

InChI: InChI=1S/C29H29N7O2S2/c1-2-7-23-20(4-1)5-3-6-21(23)19-39-29-31-24-9-8-22(18-25(24)40-29)30-26-32-27(35-10-14-37-15-11-35)34-28(33-26)36-12-16-38-17-13-36/h1-9,18H,10-17,19H2,(H,30,32,33,34)

Composition: C (60.92%), H (5.11%), N (17.15%), O (5.60%), S (11.22%)

Molar Mass: 571.72

Atom Count: 69

Heavy Atom Count: 40

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	571.18241555
Formal Charge	0
FSP3	0.31
Hetero Ring Count	4
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	1
InChIKey	JNDCDNXYHNVEFP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	162.27
Topological Polar Surface Area	88.53
Polarizability	62.6
Ring Count	7
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H29N7O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00