BTT 3033

CAT: 0926-JAC02899-01Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-JAC02899-01Size:25 mg

Selected

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

Quick Request Actions

CAS Number

1259028-99-3

MDL Number

MFCD28166480

Smiles

FC1=CC=C (N2N=CC (S (N (C3=CC=C (NC (NC4=CC=CC=C4) =O) C=C3) C) (=O) =O) =C2) C=C1

Molecular Formula

C23H20FN5O3S

Molecular Weight

465.5 g/mol

Controlled

Chemical Information

Btt-3033

CAS Number	1259028-99-3
PubChem CID	49841251
IUPAC Name	1-[4-[[1-(4-fluorophenyl)pyrazol-4-yl]sulfonyl-methylamino]phenyl]-3-phenylurea
Molecular Formula	C23H20FN5O3S
Molecular Weight	465.5
XLogP	3.3
Topological Polar Surface Area	105
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	33
Formal Charge	0
Complexity	742

SMILES

CN(C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CN(N=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN5O3S/c1-28(33(31,32)22-15-25-29(16-22)21-11-7-17(24)8-12-21)20-13-9-19(10-14-20)27-23(30)26-18-5-3-2-4-6-18/h2-16H,1H3,(H2,26,27,30)

InChIKey

NSLIQOPYDUKWTA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1259028-99-3

CID: 49841251

Formula: C23H20FN5O3S

MW: 465.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	465.5
XLogP3	3.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	465.12708885
Monoisotopic Mass	465.12708885
Topological Polar Surface Area	105 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	742
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

Catalog	Name
WJB08549-01	TCS 3035
DKB48928-01	JNJ 303

Catalog	Name
HY-110112-01	BTT-3033
T26323-01	VPC-3033
TRC-B689365-500MG	BTT 3033
A17200-25	BTT-3033 25mg
A17200-5	BTT-3033 5mg
A17200-10	BTT-3033 10mg
A17200-100	BTT-3033 100mg
A17200-50	BTT-3033 50mg
TR312526	HADHSC (HADH) Human shRNA Plasmid Kit (Locus ID 3033)
TL312526V	HADHSC (HADH) Human shRNA Lentiviral Particle (Locus ID 3033)