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CAS 73963-42-5 1-Cyclohexyl-5-(4-chlorobutyl)-1H-tetrazole molecular structure lightbox
CAS RN: 73963-42-5

1-Cyclohexyl-5-(4-chlorobutyl)-1H-tetrazole

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7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260419 100g In stock Inquiry
Batchno.20251022 25g In stock Inquiry
Batchno.20251012 5g In stock Inquiry
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Batchno.20250323 100g Out of stock Inquiry
Batchno.20260129 10g In stock Shanghai Inquiry
Batchno.20260330 25g In stock Shanghai Inquiry
Batchno.20250217 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: ICTC2013
  • Purity/Analytical Methods: >98.0%(HPLC)
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73963-42-5 / 5-(4-chlorobutyl)-1-cyclohexyltetrazole

Standard CAS: 73963-42-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73963-42-5
Multi CAS
Yes
Molecular Formula
C11H19CLN4
Molecular Weight
242.750000
Exact Mass
242.129824
InChI
InChI=1S/C11H19ClN4/c12-9-5-4-8-11-13-14-15-16(11)10-6-2-1-3-7-10/h10H,1-9H2
InChIKey
INTQSGGUSUSCTJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
5
Fraction Csp3
0.91
Rotatable bonds
5
H-bond acceptors
4
Molar refractivity
63.6
TPSA
43.6

LogP / Solubility

WLOGP
2.74
MLOGP
2.42
XLogP3
2.9
Consensus LogP
2.69
Log S (ESOL)
-2.97
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.53
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.11
Class (SILICOS-IT)
Slightly 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)
-2.26

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
1.5

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