CS-0544446
Methyl 3-(7-chloro-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)benzoate
Manufacturer: ChemScene
CAS Number: 1359410-75-5
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₁₄ClNO₄
Molecular Weight
331.75
Synonyms
None
SMILES
COC(=O)C1=CC(=CC=C1)N2CC3=C(C=CC(=C3)Cl)OCC2=O
Tpsa
55.84
Logp
3.0522
H Acceptors
4
H Donors
0
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄ClNO₄
Molecular Weight: 331.75
Synonyms: None
SMILES: COC(=O)C1=CC(=CC=C1)N2CC3=C(C=CC(=C3)Cl)OCC2=O
Tpsa: 55.84
Logp: 3.0522
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₄ClNO₄
Molecular Weight:
331.75
Synonyms:
None
SMILES:
COC(=O)C1=CC(=CC=C1)N2CC3=C(C=CC(=C3)Cl)OCC2=O
Tpsa:
55.84
Logp:
3.0522
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₈N₂S
Molecular Weight: 210.34
Synonyms: None
SMILES: S1C=CC2=C1CCN(C2)CC(N)(C)C
Tpsa: 29.26
Logp: 1.8435
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₈N₂S
Molecular Weight:
210.34
Synonyms:
None
SMILES:
S1C=CC2=C1CCN(C2)CC(N)(C)C
Tpsa:
29.26
Logp:
1.8435
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇BrN₄OS
Molecular Weight: 287.14
Synonyms: None
SMILES: O=C(C1=CC=NN1C)NC2=NC=C(Br)S2
Tpsa: 59.81
Logp: 1.8914
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BrN₄OS
Molecular Weight:
287.14
Synonyms:
None
SMILES:
O=C(C1=CC=NN1C)NC2=NC=C(Br)S2
Tpsa:
59.81
Logp:
1.8914
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₇N₃OS
Molecular Weight: 311.40
Synonyms: 1-(2,3-dimethylphenyl)-2-mercapto-5,7-dimethylpyrido[2,3-d]pyrimidin-4(1H)-one
SMILES: CC1=C(C(=CC=C1)N2C3=C(C(=CC(=N3)C)C)C(=O)NC2=S)C
Tpsa: 50.68
Logp: 3.67697
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₇N₃OS
Molecular Weight:
311.40
Synonyms:
1-(2,3-dimethylphenyl)-2-mercapto-5,7-dimethylpyrido[2,3-d]pyrimidin-4(1H)-one
SMILES:
CC1=C(C(=CC=C1)N2C3=C(C(=CC(=N3)C)C)C(=O)NC2=S)C
Tpsa:
50.68
Logp:
3.67697
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1