CAS RN: 5233-42-1

5-Chloro Hydrochlorothiazide

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250410 100mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260320 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250525 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251201 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260304 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS5233-42-1
  • Purity/Analytical Methods: >99.0%
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5233-42-1 / 5,6-dichloro-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-7-sulfonamide

Standard CAS: 5233-42-1 Multi CAS: Yes

Basic Information

CAS
5233-42-1
Multi CAS
Yes
Molecular Formula
C7H7CL2N3O4S2
Molecular Weight
332.200000
Exact Mass
330.925503
InChI
InChI=1S/C7H7Cl2N3O4S2/c8-5-3(17(10,13)14)1-4-7(6(5)9)11-2-12-18(4,15)16/h1,11-12H,2H2,(H2,10,13,14)
InChIKey
BSNKBIJVLZUERH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
3
Molar refractivity
66.65
TPSA
118.36

LogP / Solubility

WLOGP
0.3
MLOGP
0.28
XLogP3
0.6
Consensus LogP
0.39
Log S (ESOL)
-2.27
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.5
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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