JNJ-10229570 5mg

CAT: 0628-A16876-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0628-A16876-5Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

524923-88-4

Chemical Information

Benzenamine, N-(2,3-bis(2-methoxyphenyl)-1,2,4-thiadiazol-5(2H)-ylidene)-

CAS Number	524923-88-4
PubChem CID	10110895
IUPAC Name	2,3-bis(2-methoxyphenyl)-N-phenyl-1,2,4-thiadiazol-5-imine
Molecular Formula	C22H19N3O2S
Molecular Weight	389.5
XLogP	5.1
Topological Polar Surface Area	71.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	28
Formal Charge	0
Complexity	576

SMILES

COC1=CC=CC=C1C2=NC(=NC3=CC=CC=C3)SN2C4=CC=CC=C4OC

InChI

InChI=1S/C22H19N3O2S/c1-26-19-14-8-6-12-17(19)21-24-22(23-16-10-4-3-5-11-16)28-25(21)18-13-7-9-15-20(18)27-2/h3-15H,1-2H3

InChIKey

XTHRTBCPBWJYRO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 524923-88-4

CID: 10110895

Formula: C22H19N3O2S

MW: 389.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	389.5
XLogP3	5.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	389.11979803
Monoisotopic Mass	389.11979803
Topological Polar Surface Area	71.7 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	576
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes