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SRI-011381 hydrochloride

CAT: 0498-bs-6877C-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-6877C-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2070014-88-7
Conjugation
Unconjugated
Purity
98
Buffer
Powder
Solubility
DMSO: 10 mM
Smiles
Cl.O=C(NC1CCCCC1)N(CC1C=CC=CC=1)CC1CCNCC1
Molecular Formula
C20 H32 Cl N3 O
Molecular Weight
365.94
InChI
InChI=1S/C20H31N3O.ClH/c24-20 (22-19-9-5-2-6-10-19) 23 (15-17-7-3-1-4-8-17) 16-18-11-13-21-14-12-18; /h1,3-4,7-8,18-19,21H,2,5-6,9-16H2, (H,22,24) ;1H
Storage Conditions
Store in dry, dark place at -20C for 1 year.
Shelf Life
1 year
Appearance
Solid Power.

Chemical Information

SRI-011381 hydrochloride
CAS Number2070014-88-7
PubChem CID122198132
IUPAC Name1-benzyl-3-cyclohexyl-1-(piperidin-4-ylmethyl)urea;hydrochloride
Molecular FormulaC20H32ClN3O
Molecular Weight365.9
Topological Polar Surface Area44.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity369
SMILES
C1CCC(CC1)NC(=O)N(CC2CCNCC2)CC3=CC=CC=C3.Cl
InChI
InChI=1S/C20H31N3O.ClH/c24-20(22-19-9-5-2-6-10-19)23(15-17-7-3-1-4-8-17)16-18-11-13-21-14-12-18;/h1,3-4,7-8,18-19,21H,2,5-6,9-16H2,(H,22,24);1H
InChIKey
GPNMJVSGNMDOJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SRI-011381 hydrochloride
CAS: 2070014-88-7
CID: 122198132
Formula: C20H32ClN3O
MW: 365.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight365.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass365.2233903
Monoisotopic Mass365.2233903
Topological Polar Surface Area44.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity369
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes