기본 정보
- 표준 SMILES
Cc1cc(Cl)nc2c1CN(C(=O)OC(C)(C)C)CC2- InChIKey
ITGZJJFPPBULFQ-UHFFFAOYSA-N- 분자식
- C14H19ClN2O2
- 평균 분자량
- 282.76 g/mol
이름 및 식별자
- 우선 이름
- tert-butyl 2-chloro-4-methyl-7,8-dihydro-1,6-naphthyridine-6(5H)-carboxylate
- IUPAC
- tert-butyl 2-chloro-4-methyl-7,8-dihydro-5H-1,6-naphthyridine-6-carboxylate
이름 및 동의어
1421254-01-4tert-butyl 2-chloro-4-methyl-7,8-dihydro-1,6-naphthyridine-6(5H)-carboxylateMFCD27997374tert-butyl 2-chloro-4-methyl-7,8-dihydro-5H-1,6-naphthyridine-6-carboxylatetert-butyl 2-chloro-4-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-6-carboxylateSCHEMBL14663062ITGZJJFPPBULFQ-UHFFFAOYSA-NAKOS027255293AS-73387SY124323DB-085412CS-0038843
이름 더 보기
W14910F6091296-Boc-2-chloro-4-methyl-5,6,7,8-tetrahydro-1,6-naphthyridinet-Butyl 2-chloro-4-methyl-7,8-dihydro-1,6-naphthyridine-6(5H)-carboxylateTert-Butyl 2-Chloro-4-Methyl-7,8-Dihydro-1,6-Naphthyridine-6(5H)-Carboxylate(WX141813)tert-butyl2-chloro-4-methyl-7,8-dihydro-1,6-naphthyridine-6(5H)-carboxylate1,6-Naphthyridine-6(5H)-carboxylic acid, 2-chloro-7,8-dihydro-4-methyl-, 1,1-dimethylethyl ester
데이터베이스 식별자
- PubChem CID
- 86690273
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 42.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 343
관련 반응
1건
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