CAS 327079-49-2 5-AMINO-N-(4-CHLORO-PHENYL)-2-PIPERIDIN-1-YL-BENZENESULFONAMIDE molecular structure

lightbox

CAS RN: 327079-49-2

5-AMINO-N-(4-CHLORO-PHENYL)-2-PIPERIDIN-1-YL-BENZENESULFONAMIDE

Product code: SSC-138388

GET A QUOTE

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: ≥95%
Inventory rows with stock: 0
Bulk packaging: confirmed by inquiry

Request Bulk Quote

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 327079-49-2
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	≥95%	0 Out of Stock	Beijing	Inquiry

327079-49-2 / 5-amino-N-(4-chlorophenyl)-2-piperidin-1-ylbenzenesulfonamide

Standard CAS: 327079-49-2 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

327079-49-2

Multi CAS

Molecular Formula

C17H20CLN3O2S

Molecular Weight

365.900000

Exact Mass

365.096476

InChI

InChI=1S/C17H20ClN3O2S/c18-13-4-7-15(8-5-13)20-24(22,23)17-12-14(19)6-9-16(17)21-10-2-1-3-11-21/h4-9,12,20H,1-3,10-11,19H2

InChIKey

XURBEKRBQPXBGF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.29

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

99.18

TPSA

75.43

LogP / Solubility

WLOGP

3.71

MLOGP

3.29

XLogP3

3.4

Consensus LogP

3.47

Log S (ESOL)

-4.55

Class (ESOL)

Slightly soluble

Log S (Ali)

-5.24

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-5.6

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-2.32

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Yes

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

PAINS alerts

Brenk alerts

Leadlikeness

Synthetic Accessibility

2.5

5-AMINO-N-(4-CHLORO-PHENYL)-2-PIPERIDIN-1-YL-BENZENESULFONAMIDE

Historical Supply Reference

Reference Pack Sizes

327079-49-2 / 5-amino-N-(4-chlorophenyl)-2-piperidin-1-ylbenzenesulfonamide

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

Customers Also Viewed

N1,N1-DIETHYL-4-(MORPHOLINE-4-SULFONYL)-BENZENE-1,2-DIAMINE

3-[1-(2-FLUORO-PHENYL)-2,5-DIMETHYL-1H-PYRROL-3-YL]-3-OXO-PROPIONITRILE

3-AMINO-N,N-DIETHYL-4-PYRROLIDIN-1-YL-BENZENESULFONAMIDE

4-(4-FLUORO-3-METHYL-BENZENESULFONYLAMINO)-BENZOIC ACID

N-(3-CHLORO-PHENYL)-4-HYDRAZINO-3-NITRO-BENZENESULFONAMIDE

N-(4-CHLORO-PHENYL)-4-HYDRAZINO-3-NITRO-BENZENESULFONAMIDE

Get In Touch