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CAS 4108-88-7 1-Pyrrolidinesulfonamide(7CI,8CI,9CI) molecular structure lightbox
CAS RN: 4108-88-7

1-Pyrrolidinesulfonamide(7CI,8CI,9CI)

  • Product code: SSC-149494
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 4108-88-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

4108-88-7 / pyrrolidine-1-sulfonamide

Standard CAS: 4108-88-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4108-88-7
Multi CAS
No
Molecular Formula
C4H10N2O2S
Molecular Weight
150.200000
Exact Mass
150.046299
InChI
InChI=1S/C4H10N2O2S/c5-9(7,8)6-3-1-2-4-6/h1-4H2,(H2,5,7,8)
InChIKey
LPPOVVJDAVMOET-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
33.91
TPSA
63.4

LogP / Solubility

WLOGP
-0.71
MLOGP
-0.63
XLogP3
-0.7
Consensus LogP
-0.68
Log S (ESOL)
-0.26
Class (ESOL)
Very soluble
Log S (Ali)
-0.28
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.16
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-4.14

Drug-likeness / Medicinal Chemistry

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

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