CAS RN: 323196-43-6

(R)-(+)-5-Benzyl-2,2,3-trimethyl-4-imidazolidinone Hydrochloride

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251111 100mg In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20260616 10g In stock Shanghai Inquiry
Batchno.20251108 1g In stock Shanghai Inquiry
Batchno.20260425 250mg In stock Shanghai Inquiry
Batchno.20250824 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20250201 5g In stock Shanghai Inquiry
  • Product code: ICTT2990
  • Purity/Analytical Methods: >98.0%(T)(HPLC)
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323196-43-6 / (5R)-5-benzyl-2,2,3-trimethylimidazolidin-4-one;hydrochloride

Standard CAS: 323196-43-6 Multi CAS: Yes

Basic Information

CAS
323196-43-6
Multi CAS
Yes
Molecular Formula
C13H19CLN2O
Molecular Weight
254.750000
Exact Mass
254.118591
InChI
InChI=1S/C13H18N2O.ClH/c1-13(2)14-11(12(16)15(13)3)9-10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/t11-;/m1./s1
InChIKey
YIYFEXGDFJLJGM-RFVHGSKJSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.46
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
71.17
TPSA
32.34

LogP / Solubility

WLOGP
1.82
MLOGP
1.61
XLogP3
1.82
Consensus LogP
1.75
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.06
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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