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CAS 1152850-20-8 5-(3-chloro-4-fluorophenyl)-5-methylimidazolidine-2,4-dione molecular structure lightbox
CAS RN: 1152850-20-8

5-(3-chloro-4-fluorophenyl)-5-methylimidazolidine-2,4-dione

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4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260620 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250702 1g / 5g / 25g Out of stock 5-7 business days Inquiry
Batchno.20260424 25g Out of stock Inquiry
Batchno.20260206 5g In stock Shanghai, Tianjin Inquiry
  • Product code: starshine_CAS1152850-20-8
  • Purity/Analytical Methods: >99.0%
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1152850-20-8 / 5-(3-chloro-4-fluorophenyl)-5-methylimidazolidine-2,4-dione

5-(3-chloro-4-fluorophenyl)-5-methylimidazolidine-2,4-dione | MFCD11156248 | 5-(3-Chloro-4-fluorophenyl)-5-methyl-2,4-imidazolidinedione

Standard CAS: 1152850-20-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1152850-20-8
Multi CAS
No
Molecular Formula
C10H8ClFN2O2
Molecular Weight
242.630000
Exact Mass
242.025833
SMILES
CC1(C(=O)NC(=O)N1)C2=CC(=C(C=C2)F)Cl
InChI
InChI=1S/C10H8ClFN2O2/c1-10(8(15)13-9(16)14-10)5-2-3-7(12)6(11)4-5/h2-4H,1H3,(H2,13,14,15,16)
InChIKey
WVEPYQAJSBOLQH-UHFFFAOYSA-N
Synonyms
5-(3-chloro-4-fluorophenyl)-5-methylimidazolidine-2,4-dione MFCD11156248 5-(3-Chloro-4-fluorophenyl)-5-methyl-2,4-imidazolidinedione SCHEMBL26965618 SCHEMBL29949272

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
55.44
TPSA
58.2

LogP / Solubility

WLOGP
1.53
MLOGP
1.35
XLogP3
1.7
Consensus LogP
1.53
Log S (ESOL)
-2.52
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.66
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.63
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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