WHI-P180 5mg

CAT: 0628-A15509-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0628-A15509-5Size:5 mg

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

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CAS Number

211555-08-7

Chemical Information

4-(3-Hydroxyanilino)-6,7-Dimethoxyquinazoline

CAS Number	211555-08-7
PubChem CID	5687
IUPAC Name	3-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol
Molecular Formula	C16H15N3O3
Molecular Weight	297.31
XLogP	3
Topological Polar Surface Area	76.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	358

SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)O)OC

InChI

InChI=1S/C16H15N3O3/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-4-3-5-11(20)6-10/h3-9,20H,1-2H3,(H,17,18,19)

InChIKey

BNDYIYYKEIXHNK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 211555-08-7

CID: 5687

Formula: C16H15N3O3

MW: 297.31

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	297.31
XLogP3	3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	297.11134135
Monoisotopic Mass	297.11134135
Topological Polar Surface Area	76.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	358
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